SCHEMBL3601616

SCHEMBL3601616

Cc1cc(C)c2c(c1)OC(C)C2

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 16/20 0.44
MAOB P27338 5/20 0.39
BRD4 O60885 1/20 0.39
CREBBP Q92793 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 1/20 0.38
POLL Q9UGP5 1/20 0.35

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
SCHEMBL14449468 0.78 UGT2B17 (0.38) MAOAMAOBALDH1A1HPGDMAPT
SCHEMBL757921 0.73 PGAM1 (0.33) MAOA
SCHEMBL9825767 0.73 SIRT2 (0.32) MAOA
SCHEMBL9825755 0.73 UGT2B17 (0.30)
SCHEMBL28028010 0.73 ALDH1A1 (0.33) MAOAALDH1A1MAPT
SCHEMBL7947753 0.72 KDM4E (0.47) MAOAMAOBBRD4CREBBPALDH1A1
SCHEMBL3605365 0.72 MAOA (0.41) MAOAMAOBBRD4CREBBPALDH1A1
SCHEMBL3605401 0.72 MAOA (0.41) MAOAMAOBBRD4CREBBPALDH1A1
SCHEMBL19545899 0.71 MAPT (0.33) MAOBALDH1A1HPGDMAPT
SCHEMBL13255878 0.71 MAPT (0.33) MAOBALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021155321-A2 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed
WO-2020160180-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2020-08-06 WO disclosed
EP-1637527-B1 CANNABINOID RECEPTOR MODULATOR TAKEDA PHARMACEUTICAL (JP) 2013-04-17 EP disclosed
US-20100240743-A1 CANNABINOID RECEPTOR MODULATOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-23 US disclosed
US-7507841-B2 Carbamoylamino-substituted 2,3-dihydro-benzofurans, indoles and benzothiophenes, e.g., (+)-N-((3R)-3-(4-isopropylphenyl)-4,6,7-trimethyl-2,3-dihydro-1-benzofuran-5-yl)-3,3-dimethylbutanamide; cerebrovascular disorders TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-03-24 US disclosed
US-20090023800-A1 Cannabinoid receptor modulator TAKEDA PHARMACEUTICAL COMPANY LIMITED 2009-01-22 US disclosed
US-7465815-B2 Cannabinoid receptor modulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-16 US disclosed
US-20080021087-A1 Cannabinoid receptor modulator TAKEDA PHARMACEUTICAL COMPANY LIMITED 2008-01-24 US disclosed
US-20070099990-A1 Cannabinoid receptor modulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-05-03 US disclosed
EP-1637527-A1 CANNABINOID RECEPTOR MODULATOR Takeda Pharmaceutical Company Limited (JP) 2006-03-22 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 (4 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-20100240743-A1 CANNABINOID RECEPTOR MODULATOR CNR1, CNR2, GPR18 MAOA 1094/4885MAOB 610/4885BRD4 63/4885
US-20080021087-A1 Cannabinoid receptor modulator CNR1, CNR2, GPR18 MAOA 1094/4885MAOB 610/4885BRD4 63/4885
US-20090023800-A1 Cannabinoid receptor modulator CNR1, CNR2, GPR18 MAOA 1094/4885MAOB 610/4885BRD4 63/4885
US-20070099990-A1 Cannabinoid receptor modulator CNR1, CNR2, GPR18 MAOA 1094/4885MAOB 610/4885BRD4 63/4885

“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.