SCHEMBL276982

SCHEMBL276982

CCOC(=O)COc1ccc(-c2c(C)c(C(=O)O)nn2-c2ccc(C)cc2C)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
TP53 P04637 1/20 0.43
NPC1 O15118 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
CNR1 P21554 3/20 0.40
PPARA Q07869 1/20 0.40
GAA P10253 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CNR2 P34972 4/20 0.39
ADORA2A P29274 1/20 0.38
ADORA2B P29275 1/20 0.38

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
SCHEMBL276598 0.88 CNR1 (0.41) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL13437230 0.87 KDM4E (0.44) KDM4EMAPTALDH1A1L3MBTL1CNR1
SCHEMBL277227 0.80 CNR1 (0.48) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL24208982 0.76 CNR1 (0.56) CNR1CNR2
SCHEMBL277049 0.75 CNR1 (0.57) MAPTCNR1NPSR1CNR2
SCHEMBL13437233 0.75 CNR1 (0.39) MAPTALDH1A1CNR1PPARAGAA
SCHEMBL25513993 0.74 CNR2 (0.46) KDM4ECNR1CNR2
SCHEMBL277180 0.73 CNR1 (0.56) MAPTCNR1NPSR1CNR2
SCHEMBL25513646 0.73 CNR2 (0.47) KDM4EHSD17B10CNR1CNR2
SCHEMBL13437232 0.72 CNR1 (0.57) MAPTCNR1NPSR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133904-B2 Cannabinoid receptor antagonists/inverse agonists useful for treating obesity JENRIN DISCOVERY, INC. (US) 2012-03-13 US disclosed
US-8088798-B2 Cannabinoid receptor antagonists/inverse agonists useful for treating obesity Jensen Discovery, Inc. 2012-01-03 US disclosed
US-20100144791-A1 CANNABINOID RECEPTOR ANTAGONISTS/INVERSE AGONISTS USEFUL FOR TREATING OBESITY JENRIN DISCOVERY (US) 2010-06-10 US disclosed
US-20090069329-A1 CANNABINOID RECEPTOR ANTAGONISTS/INVERSE AGONISTS USEFUL FOR TREATING OBESITY JENRIN DISCOVERY (US) 2009-03-12 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 (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-20100144791-A1 CANNABINOID RECEPTOR ANTAGONISTS/INVERSE AGONISTS USEFUL FOR TREATING OBESITY CNR2, CNR1, GPR119 KDM4E 1728/4885MAPT 4267/4885ALDH1A1 3407/4885
US-20090069329-A1 CANNABINOID RECEPTOR ANTAGONISTS/INVERSE AGONISTS USEFUL FOR TREATING OBESITY CNR2, CNR1, GPR119 KDM4E 1728/4885MAPT 4267/4885ALDH1A1 3407/4885

“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.