SCHEMBL10165860

SCHEMBL10165860

CC(C)C(=O)COc1ccc(C(C)C)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.58
KMT2A Q03164 2/20 0.54
FKBP1A P62942 1/20 0.54
NPC1 O15118 3/20 0.53
ALDH1A1 P00352 5/20 0.51
TSHR P16473 1/20 0.51
RXRA P19793 1/20 0.51
RXRB P28702 1/20 0.51
RECQL P46063 1/20 0.48
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.48
UBE2N P61088 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.47
TRPM8 Q7Z2W7 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
OXTR P30559 1/20 0.45
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL21100162 0.90 ALDH1A1 (0.50) RAB9AALDH1A1TSHRMAPTKDM4E
SCHEMBL10636547 0.85 PTGS2 (0.51) RAB9AKMT2ANPC1ALDH1A1MEN1
SCHEMBL24934757 0.85 RAB9A (0.48) RAB9AKMT2AFKBP1ANPC1ALDH1A1
SCHEMBL24935661 0.84 RAB9A (0.47) RAB9AKMT2AFKBP1ANPC1ALDH1A1
SCHEMBL24935185 0.84 KMT2A (0.50) RAB9AKMT2AFKBP1ANPC1RXRA
SCHEMBL17245028 0.83 LMNA (0.53) RAB9AKMT2AFKBP1ANPC1ALDH1A1
SCHEMBL8302859 0.83 RAB9A (0.59) RAB9AKMT2AFKBP1ANPC1ALDH1A1
SCHEMBL801233 0.83 ALDH1A1 (0.72) RAB9AKMT2AFKBP1ANPC1ALDH1A1
SCHEMBL25144590 0.81 MAPT (0.47) RAB9ANPC1ALDH1A1TSHRMAPT
SCHEMBL6717854 0.81 RAB9A (0.58) RAB9AKMT2AFKBP1ANPC1ALDH1A1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030911-B2 Synthesis and biological activity of phosphoramidimidate and phosphoramidate DNA THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2024-07-09 US disclosed
US-20230054270-A1 BIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF SUZHOU KINTOR PHARMACEUTICALS, INC. (CN) 2023-02-23 US disclosed
EP-4119546-A1 BIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Suzhou Kintor Pharmaceuticals, Inc. (CN) 2023-01-18 EP disclosed
US-20220144867-A1 SYNTHESIS OF BACKBONE MODIFIED MORPHOLINO OLIGONUCLEOTIDES AND CHIMERAS USING PHOSPHORAMIDITE CHEMISTRY UNIV COLORADO REGENTS (US) 2022-05-12 US disclosed
US-11230565-B2 Synthesis of backbone modified morpholino oligonucleotides and chimeras using phosphoramidite chemistry THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2022-01-25 US disclosed
US-10882884-B2 Stereoselective synthesis of phosphorothioate oligoribonucleotides ETH ZURICH (CH) 2021-01-05 US disclosed
US-20190218236-A1 SYNTHESIS OF BACKBONE MODIFIED MORPHOLINO OLIGONUCLEOTIDES AND CHIMERAS USING PHOSPHORAMIDITE CHEMISTRY THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2019-07-18 US disclosed
US-20190135849-A1 STEREOSELECTIVE SYNTHESIS OF PHOSPHOROTHIOATE OLIGORIBONUCLEOTIDES ETH ZURICH (CH) 2019-05-09 US disclosed
US-20120035194-A1 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS PFIZER INC. (US) 2012-02-09 US disclosed
US-7998978-B2 Substituted 2-amino-fused heterocyclic compounds PFIZER INC. (US) 2011-08-16 US disclosed
US-20100056506-A1 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS PFIZER PRODUCTS INC. (US) 2010-03-04 US 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-12030911-B2 Synthesis and biological activity of phosphoramidimidate and phosphoramidate DNA RNASEH1, RNASE1, DNASE1 RAB9A 3900/4885KMT2A 2433/4885FKBP1A 2259/4885
US-20120035194-A1 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS MAPK1, SLC5A1, ATF1 RAB9A 1586/4885KMT2A 1703/4885FKBP1A 1275/4885
US-20100056506-A1 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS MAPK1, SLC5A1, ATF1 RAB9A 1586/4885KMT2A 1703/4885FKBP1A 1275/4885
US-11230565-B2 Synthesis of backbone modified morpholino oligonucleotides and chimeras using phosphoramidite chemistry RNASEH1, RNASE1, PMM2 RAB9A 4314/4885KMT2A 996/4885FKBP1A 2977/4885
US-20220144867-A1 SYNTHESIS OF BACKBONE MODIFIED MORPHOLINO OLIGONUCLEOTIDES AND CHIMERAS USING PHOSPHORAMIDITE CHEMISTRY RNASEH1, RNASE1, PMM2 RAB9A 4314/4885KMT2A 996/4885FKBP1A 2977/4885
US-20190218236-A1 SYNTHESIS OF BACKBONE MODIFIED MORPHOLINO OLIGONUCLEOTIDES AND CHIMERAS USING PHOSPHORAMIDITE CHEMISTRY RNASEH1, RNASE1, PMM2 RAB9A 4314/4885KMT2A 996/4885FKBP1A 2977/4885
US-20190135849-A1 STEREOSELECTIVE SYNTHESIS OF PHOSPHOROTHIOATE OLIGORIBONUCLEOTIDES RNGTT, TYMS, POLR2E RAB9A 4069/4885KMT2A 4304/4885FKBP1A 572/4885
US-10882884-B2 Stereoselective synthesis of phosphorothioate oligoribonucleotides RNGTT, TYMS, POLR2E RAB9A 4069/4885KMT2A 4304/4885FKBP1A 572/4885
US-20230054270-A1 BIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF AR, SHBG, NR5A1 RAB9A 4121/4885KMT2A 1807/4885FKBP1A 1360/4885

“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.