SCHEMBL15020704

SCHEMBL15020704

Nc1[nH]nc(C2CC2)c1-c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 1/20 0.45
▸ MAP3K14 Q99558 1/20 0.45
▸ MAPT P10636 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ MKNK1 Q9BUB5 1/20 0.40
▸ MKNK2 Q9HBH9 1/20 0.40
▸ ALPL P05186 1/20 0.40
▸ MAPK11 Q15759 4/20 0.38
▸ MAPK14 Q16539 4/20 0.38
▸ TP53 P04637 1/20 0.37
▸ MDM2 Q00987 1/20 0.37
▸ DRD4 P21917 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NOTUM Q6P988 1/20 0.36
▸ BRD2 P25440 2/20 0.35
▸ BRD3 Q15059 2/20 0.35
▸ CREBBP Q92793 2/20 0.35
▸ BRD4 O60885 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
SCHEMBL20837070 0.83 MAPK1 (0.43) GAAMKNK1MKNK2MEN1MAPK1
SCHEMBL23635325 0.76 HTR3A (0.40) MAPTGAATP53MEN1MAPK1
SCHEMBL13516075 0.75 IKBKB (0.68) IKBKBMAP3K14MAPTGAAMKNK1
SCHEMBL30737651 0.74 MAPK11 (0.43) IKBKBMAP3K14MAPTGAAMKNK1
SCHEMBL1248139 0.73 IKBKB (0.59) IKBKBMAP3K14MAPTGAAMKNK1
SCHEMBL13516437 0.73 IKBKB (0.50) IKBKBMAP3K14MAPTGAAMKNK1
SCHEMBL20564864 0.71 ALDH1A1 (0.37) MAPTGAAMAPK1BRD2BRD3
SCHEMBL1279682 0.69 IKBKB (0.46) IKBKBMAP3K14MAPTGAAMKNK1
SCHEMBL19927642 0.69 RPS6KA5 (0.49) IKBKBMAP3K14GAAMKNK1MKNK2
SCHEMBL30737561 0.68 SIRT1 (0.44) MKNK1MKNK2ALPLMAPK11MAPK14

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
CN-103153999-B Compounds as cannabinoid receptor-1 inhibitors AMOREPACIFIC CORP. (KR) 2016-06-01 — — CN disclosed
US-8975264-B2 Compound acting as a cannabinoid receptor-1 inhibitor AMOREPACIFIC CORPORATION (KR) 2015-03-10 — — US disclosed
US-8975264-B2 Compound acting as a cannabinoid receptor-1 inhibitor AMOREPACIFIC CORPORATION (KR) 2015-03-10 — — US disclosed
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
US-20130158025-A1 NOVEL COMPOUND ACTING AS A CANNABINOID RECEPTOR-1 INHIBITOR AMOREPACIFIC CORPORATION (KR) 2013-06-20 — — US disclosed
US-20130158025-A1 NOVEL COMPOUND ACTING AS A CANNABINOID RECEPTOR-1 INHIBITOR AMOREPACIFIC CORPORATION (KR) 2013-06-20 — — US disclosed
CN-103153999-A Novel compounds as cannabinoid receptor-1 inhibitors AMOREPACIFIC CORP 2013-06-12 — — CN 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 IKBKB 1575/4885MAP3K14 1973/4885MAPT 2617/4885

“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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