SCHEMBL81881

SCHEMBL81881

Cc1ccc(N2CCCCC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.61
ALDH1A1 P00352 8/20 0.59
MAPT P10636 7/20 0.59
RECQL P46063 2/20 0.59
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
L3MBTL1 Q9Y468 4/20 0.58
KDM4E B2RXH2 3/20 0.58
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
GAA P10253 2/20 0.58
ALOX15 P16050 2/20 0.58
NPSR1 Q6W5P4 2/20 0.58
USP2 O75604 1/20 0.58
TP53 P04637 1/20 0.58
POLB P06746 1/20 0.58
THRB P10828 1/20 0.58
HTT P42858 1/20 0.58
HSD17B10 Q99714 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.56

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
SCHEMBL82441 1.00 ADRB1 (0.61) ADRB1ALDH1A1MAPTRECQLMEN1
SCHEMBL28567064 1.00 ADRB1 (0.61) ADRB1ALDH1A1MAPTRECQLMEN1
Lithium SCHEMBL31448685 0.98 ADRB1 (0.59) ADRB1ALDH1A1MAPTRECQLMEN1
SCHEMBL21065781 0.98 ADRB1 (0.59) ADRB1ALDH1A1MAPTRECQLMEN1
Bromide SCHEMBL4039488 0.98 ADRB1 (0.59) ADRB1ALDH1A1MAPTRECQLMEN1
SCHEMBL327765 0.97 ADRB1 (0.64) ADRB1ALDH1A1MAPTRECQLMEN1
Hydrochloric Acid SCHEMBL16446845 0.95 ADRB1 (0.61) ADRB1ALDH1A1MAPTRECQLMEN1
SCHEMBL18118476 0.92 ADRB1 (0.64) ADRB1ALDH1A1MAPTRECQLMEN1
SCHEMBL14866966 0.88 MAPT (0.50) ADRB1ALDH1A1MAPTRECQLMEN1
SCHEMBL18806576 0.88 MAPT (0.50) ADRB1ALDH1A1MAPTRECQLMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543919-B1 USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS IN THE MANUFACTURE OF A MEDICAMENT FOR TREATMENT OF CNS DISEASES SEARLE & CO (US) 1996-04-10 EP claimed
EP-0434341-B1 Diazine derivatives ZENECA LTD (GB) 1995-05-17 EP claimed
US-5252567-A Cardiovascular disorders, sino-atrial node effects IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-10-12 US claimed
EP-0543919-A1 USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS FOR TREATMENT OF CNS DISEASES. SEARLE & CO (US) 1993-06-02 EP claimed
WO-1992003131-A1 USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS FOR TREATMENT OF CNS DISEASES G.D. SEARLE & CO. (US) 1992-03-05 WO claimed
EP-0434341-A1 Diazine derivatives ZENECA LIMITED (GB) 1991-06-26 EP claimed
CN-122011026-A Asymmetric bidentate phosphine ligand and synthesis method thereof 淮北师范大学 2026-05-12 CN disclosed
CN-119751410-A Method for thoroughly reducing aromatic oxide 郑州大学 2025-04-04 CN disclosed
US-12043621-B2 Small molecule inhibitors of Interleukin-4 TRUSTEES OF BOSTON UNIVERSITY (US) 2024-07-23 US disclosed
EP-4008790-B1 MONOAZO DYES WITH CYCLIC AMINE AS FLUORESCENCE QUENCHERS ENZO BIOCHEM INC (US) 2024-07-17 EP disclosed
US-12018048-B2 Anthelmintic depsipeptide compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2024-06-25 US disclosed
US-12018048-B2 Anthelmintic depsipeptide compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2024-06-25 US disclosed
WO-2024107393-A1 TRICYCLIC COMPOUNDS SCHRÖDINGER, INC. (US) 2024-05-23 WO disclosed
EP-0543919-A1 USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS FOR TREATMENT OF CNS DISEASES. SEARLE & CO (US) 1993-06-02 EP disclosed
EP-0499266-A1 Endothelin antagonist TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-08-19 EP disclosed
WO-1992003131-A1 USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS FOR TREATMENT OF CNS DISEASES G.D. SEARLE & CO. (US) 1992-03-05 WO disclosed
EP-0470256-A1 PEPTIDE DERIVATIVES AND PRODUCTION THEREOF Takeda Chemical Industries, Ltd. (JP) 1992-02-12 EP disclosed
WO-1991013089-A1 PEPTIDE DERIVATIVES AND PRODUCTION THEREOF TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-09-05 WO disclosed
EP-0434341-A1 Diazine derivatives ZENECA LIMITED (GB) 1991-06-26 EP disclosed
EP-0029286-A1 Pyrrolo(3,4-c)quinoline derivatives, processes therefor, and pharmaceutical compositions ICI AMERICAS INC. (US) 1981-05-27 EP 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 (2 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-12018048-B2 Anthelmintic depsipeptide compounds VIP, DNPEP, DPEP1 ADRB1 4475/4885ALDH1A1 2924/4885MAPT 3676/4885
US-12043621-B2 Small molecule inhibitors of Interleukin-4 IL4, IL2, IL4I1 ADRB1 4080/4885ALDH1A1 3144/4885MAPT 1310/4885

“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.