SCHEMBL3603534

SCHEMBL3603534

Cc1oc2c(C)c(C)c(NC(=O)CC(C)(C)C)c(C)c2c1-c1ccc(C(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
KCNQ2 O43526 4/20 0.33
HPGD P15428 4/20 0.33
BCL2 P10415 1/20 0.33
MCL1 Q07820 1/20 0.33
BAD Q92934 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
KIF11 P52732 1/20 0.32
CYP26A1 O43174 1/20 0.32
SMN1; SMN2 Q16637 4/20 0.32
HTT P42858 2/20 0.32
GAA P10253 2/20 0.31
KCNQ3 O43525 2/20 0.31
RAB9A P51151 2/20 0.31
MAPT P10636 1/20 0.31
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL3609082 0.81 L3MBTL1 (0.36) MAOBL3MBTL1KCNQ2HPGDMEN1
SCHEMBL2914392 0.80 CACNA1H (0.47) HPGDMEN1KMT2ASMN1; SMN2HTT
SCHEMBL2911832 0.80 LMNA (0.42) MAOBHPGDMEN1KMT2ASMN1; SMN2
SCHEMBL2913204 0.78 ADCY1 (0.39) GAARAB9AMAPTKDM4ENPC1
SCHEMBL2911971 0.76 RAB9A (0.44) MAOBL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL4046157 0.72 BCL2 (0.41) BCL2MCL1BADMEN1KMT2A
SCHEMBL2907284 0.71 MEN1 (0.37) L3MBTL1HPGDBCL2MCL1BAD
SCHEMBL3600065 0.70 MAOB (0.38) MAOBL3MBTL1KCNQ2HPGDMEN1
SCHEMBL3945392 0.70 KDM4E (0.34) HPGDBCL2MCL1BADMEN1
SCHEMBL2911517 0.69 NPC1 (0.41) L3MBTL1SMN1; SMN2GAARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20100048597-A1 Organic Compounds and Their Uses NOVARTIS AG 2010-02-25 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 (5 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-20100048597-A1 Organic Compounds and Their Uses OAT, OTC, AOX1 MAOB 70/4885L3MBTL1 1027/4885KCNQ2 2408/4885
US-20100240743-A1 CANNABINOID RECEPTOR MODULATOR CNR1, CNR2, GPR18 MAOB 610/4885L3MBTL1 3559/4885KCNQ2 630/4885
US-20080021087-A1 Cannabinoid receptor modulator CNR1, CNR2, GPR18 MAOB 610/4885L3MBTL1 3559/4885KCNQ2 630/4885
US-20090023800-A1 Cannabinoid receptor modulator CNR1, CNR2, GPR18 MAOB 610/4885L3MBTL1 3559/4885KCNQ2 630/4885
US-20070099990-A1 Cannabinoid receptor modulator CNR1, CNR2, GPR18 MAOB 610/4885L3MBTL1 3559/4885KCNQ2 630/4885

“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.