SCHEMBL15021385

SCHEMBL15021385

COCc1nn2c(-c3ccc(F)cc3)cc(N3CCCC3CO)nc2c1-c1ccc2c(c1)OCO2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 1/20 0.40
▸ SCN9A Q15858 1/20 0.40
▸ ITGB2 P05107 2/20 0.37
▸ ICAM1 P05362 2/20 0.37
▸ ITGAL P20701 2/20 0.37
▸ KDM4E B2RXH2 5/20 0.37
▸ ALDH1A1 P00352 5/20 0.37
▸ CDK1 P06493 1/20 0.36
▸ FYN P06241 1/20 0.35
▸ RAB9A P51151 2/20 0.34
▸ AVPR1A P37288 1/20 0.34
▸ SCD5 Q86SK9 3/20 0.34
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HPGD P15428 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ HCRTR1 O43613 1/20 0.33
▸ HCRTR2 O43614 1/20 0.33

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
SCHEMBL15020537 0.93 KDM4E (0.37) FPR2SCN9AITGB2ICAM1ITGAL
SCHEMBL15020822 0.88 FPR2 (0.41) FPR2SCN9AITGB2ICAM1ITGAL
SCHEMBL15020601 0.88 ALDH1A1 (0.40) ITGB2ICAM1ITGALKDM4EALDH1A1
SCHEMBL15042227 0.87 FPR2 (0.46) FPR2SCN9AITGB2ICAM1ITGAL
SCHEMBL15021019 0.87 FPR2 (0.46) FPR2SCN9AITGB2ICAM1ITGAL
SCHEMBL15020570 0.87 FPR2 (0.42) FPR2SCN9AITGB2ICAM1ITGAL
SCHEMBL15020889 0.86 KDM4E (0.36) FPR2SCN9AITGB2ICAM1ITGAL
SCHEMBL257696 0.83 ITGB2 (0.40) FPR2SCN9AITGB2ICAM1ITGAL
SCHEMBL15020670 0.81 LMNA (0.37) ITGB2ICAM1ITGALKDM4EALDH1A1
SCHEMBL257516 0.81 ALDH1A1 (0.45) ITGB2ICAM1ITGALKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8975264-B2 Compound acting as a cannabinoid receptor-1 inhibitor AMOREPACIFIC CORPORATION (KR) 2015-03-10 — — US claimed
EP-2617723-A2 NOVEL COMPOUND ACTING AS A CANNABINOID RECEPTOR-1 INHIBITOR Amorepacific Corporation (KR) 2013-07-24 — — EP claimed
US-20130158025-A1 NOVEL COMPOUND ACTING AS A CANNABINOID RECEPTOR-1 INHIBITOR AMOREPACIFIC CORPORATION (KR) 2013-06-20 — — US claimed
US-8975264-B2 Compound acting as a cannabinoid receptor-1 inhibitor AMOREPACIFIC CORPORATION (KR) 2015-03-10 — — US disclosed
EP-2617723-A2 NOVEL COMPOUND ACTING AS A CANNABINOID RECEPTOR-1 INHIBITOR Amorepacific Corporation (KR) 2013-07-24 — — EP disclosed
US-20130158025-A1 NOVEL COMPOUND ACTING AS A CANNABINOID RECEPTOR-1 INHIBITOR AMOREPACIFIC CORPORATION (KR) 2013-06-20 — — 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 (1 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-20130158025-A1 NOVEL COMPOUND ACTING AS A CANNABINOID RECEPTOR-1 INHIBITOR CNR1, CNR2, GPR18 FPR2 2908/4885SCN9A 615/4885ITGB2 4807/4885

“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.

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