SCHEMBL6943838

SCHEMBL6943838

Cc1cccc(CN2CCC(N)CC2)c1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.58
ACHE P22303 1/20 0.58
CXCR4 P61073 2/20 0.54
ALDH1A1 P00352 4/20 0.54
KDM4E B2RXH2 2/20 0.54
MAPT P10636 1/20 0.54
HTT P42858 1/20 0.52
BCHE P06276 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
DRD4 P21917 3/20 0.50
CHRM2 P08172 1/20 0.50
CHRM3 P20309 1/20 0.50
DRD2 P14416 1/20 0.50
DRD3 P35462 1/20 0.50
PARP1 P09874 1/20 0.49
PARP2 Q9UGN5 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17967809 0.91 BCHE (0.56) BACE1ACHECXCR4ALDH1A1KDM4E
SCHEMBL12447 0.89 BACE1 (0.59) BACE1ACHECXCR4ALDH1A1KDM4E
SCHEMBL27895731 0.85 ACHE (0.59) BACE1ACHECXCR4ALDH1A1KDM4E
SCHEMBL156415 0.85 ACHE (0.67) BACE1ACHECXCR4ALDH1A1KDM4E
SCHEMBL6524716 0.84 CXCR4 (0.58) BACE1ACHECXCR4ALDH1A1KDM4E
SCHEMBL10500821 0.84 ACHE (0.58) BACE1ACHECXCR4ALDH1A1KDM4E
SCHEMBL18082888 0.84 BACE1 (0.58) BACE1ACHECXCR4ALDH1A1KDM4E
SCHEMBL3145993 0.83 MEN1 (0.45) BACE1ACHECXCR4ALDH1A1KDM4E
SCHEMBL15933738 0.82 CXCR4 (0.56) BACE1ACHECXCR4ALDH1A1KDM4E
SCHEMBL14492265 0.81 CXCR4 (0.62) BACE1ACHECXCR4ALDH1A1KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12605373-B2 Methods and compositions of inhibiting DCN1-UBC12 interaction MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2026-04-21 US disclosed
US-20250120965-A1 METHODS AND COMPOSITIONS OF INHIBITING DCN1-UBC12 INTERACTION MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2025-04-17 US disclosed
US-11963954-B2 Methods and compositions of inhibiting DCN1-UBC12 interaction MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2024-04-23 US disclosed
US-20230021224-A1 METHODS AND COMPOSITIONS OF INHIBITING DCN1-UBC12 INTERACTION MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2023-01-19 US disclosed
EP-3349743-B1 METHODS AND COMPOSITIONS OF INHIBITING DCN1-UBC12 INTERACTION ST JUDE CHILDRENS RES HOSPITAL (US) 2022-04-06 EP disclosed
US-11116757-B2 Methods and compositions of inhibiting DCN1-UBC12 interaction MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2021-09-14 US disclosed
CN-107567445-B 2-phenyl-3H-imidazo [4,5-B ] pyridine derivatives useful as inhibitors of mammalian tyrosine kinase ROR1 activity 坎塞拉有限公司 2021-06-29 CN disclosed
US-20210069172-A1 METHODS AND COMPOSITIONS OF INHIBITING DCN1-UBC12 INTERACTION MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2021-03-11 US disclosed
US-20180256558-A1 METHODS AND COMPOSITIONS OF INHIBITING DCN1-UBC12 INTERACTION MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2018-09-13 US disclosed
EP-3349743-A1 METHODS AND COMPOSITIONS OF INHIBITING DCN1-UBC12 INTERACTION St. Jude Children's Research Hospital (US) 2018-07-25 EP disclosed
US-20100261701-A1 8-Substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2010-10-14 US disclosed
WO-2010038465-A1 8-SUBSTITUTED ISOQUINOLINE DERIVATIVE AND USE THEREOF 旭化成ファーマ株式会社 (JP) 2010-04-08 WO disclosed
CN-1143858-C 6, 9-disubstituted 2- [ trans- (aminocyclohexyl) amino ] purines, compositions and uses thereof ������ҩ�����޹�˾ 2004-03-31 CN disclosed
US-6642231-B2 Antineoplastic agents, treatment for neuronal injury and degeneration AVENTIS PHARMACEUTICALS INC. 2003-11-04 US disclosed
EP-1056744-B1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMA INC (US) 2003-10-22 EP disclosed
US-20030105098-A1 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines AVENTISUB II INC. 2003-06-05 US disclosed
US-6479487-B1 INHIBIT CYCLIN DEPENDENT KINASES, PARTICULARLY CDK-2; ANTIAPOPTOSIS AGENT; INHIBITS DEVELOPMENT OF NEOPLASMS AVENTIS PHARMACEUTICALS INC. 2002-11-12 US disclosed
CN-1292789-A 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines AWANDIS PHARMACEUTICAL CORP (US) 2001-04-25 CN disclosed
EP-1056744-A1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES Aventis Pharmaceuticals Inc. (US) 2000-12-06 EP disclosed
WO-1999043675-A1 6,9-DISUBSTITUTED 2-[TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMACEUTICALS INC. (US) 1999-09-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030105098-A1 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines CDK6, CDK5, CDK2 BACE1 1436/4885ACHE 3357/4885CXCR4 1646/4885
US-20180256558-A1 METHODS AND COMPOSITIONS OF INHIBITING DCN1-UBC12 INTERACTION UBQLN1, CUL1, DCUN1D1 BACE1 2234/4885ACHE 3169/4885CXCR4 4465/4885
US-12605373-B2 Methods and compositions of inhibiting DCN1-UBC12 interaction CUL3, CUL1, CUL5 BACE1 3307/4885ACHE 4566/4885CXCR4 3890/4885
US-20230021224-A1 METHODS AND COMPOSITIONS OF INHIBITING DCN1-UBC12 INTERACTION UBQLN1, CUL1, DCUN1D1 BACE1 2234/4885ACHE 3169/4885CXCR4 4465/4885
US-11116757-B2 Methods and compositions of inhibiting DCN1-UBC12 interaction UBQLN1, CUL1, DCUN1D1 BACE1 2234/4885ACHE 3169/4885CXCR4 4465/4885
US-11963954-B2 Methods and compositions of inhibiting DCN1-UBC12 interaction UBQLN1, CUL1, DCUN1D1 BACE1 2234/4885ACHE 3169/4885CXCR4 4465/4885
US-20100261701-A1 8-Substituted isoquinoline derivative and the use thereof RELA, NFKBIA, NFKB2 BACE1 1397/4885ACHE 3001/4885CXCR4 2491/4885
US-20210069172-A1 METHODS AND COMPOSITIONS OF INHIBITING DCN1-UBC12 INTERACTION UBQLN1, CUL1, DCUN1D1 BACE1 2234/4885ACHE 3169/4885CXCR4 4465/4885
US-20250120965-A1 METHODS AND COMPOSITIONS OF INHIBITING DCN1-UBC12 INTERACTION UBQLN1, CUL1, DCUN1D1 BACE1 2234/4885ACHE 3169/4885CXCR4 4465/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.