SCHEMBL3550764

SCHEMBL3550764

COc1ccc(C2CCN(C(=O)c3cnoc3-c3ccccc3Cl)C2)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCD5 Q86SK9 1/20 0.52
ALDH1A1 P00352 3/20 0.48
LMNA P02545 3/20 0.48
HPGD P15428 1/20 0.48
HIF1A Q16665 1/20 0.48
RAB9A P51151 3/20 0.46
MAPT P10636 2/20 0.45
HSD11B1 P28845 2/20 0.45
NPC1 O15118 2/20 0.42
PROKR1 Q8TCW9 6/20 0.42
ROCK2 O75116 1/20 0.41
MGLL Q99685 1/20 0.41

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
SCHEMBL3544990 0.90 SCD5 (0.54) SCD5LMNARAB9AMAPTHSD11B1
SCHEMBL3542433 0.89 SCD5 (0.56) SCD5ALDH1A1LMNARAB9AMAPT
SCHEMBL3542867 0.89 SCD5 (0.63) SCD5LMNARAB9AMAPTHSD11B1
SCHEMBL3550082 0.89 SCD5 (0.55) SCD5LMNARAB9AMAPTHSD11B1
SCHEMBL3544586 0.88 SCD5 (0.54) SCD5ALDH1A1LMNARAB9AMAPT
SCHEMBL3546587 0.85 SCD5 (0.52) SCD5LMNARAB9AMAPTHSD11B1
SCHEMBL3548997 0.85 CYP2C9 (0.45) ALDH1A1LMNARAB9ANPC1
SCHEMBL3547284 0.85 ALDH1A1 (0.56) SCD5ALDH1A1LMNAHPGDHIF1A
SCHEMBL3545291 0.83 SCD5 (0.50) SCD5ALDH1A1RAB9AHSD11B1NPC1
SCHEMBL13501697 0.83 SCD5 (0.54) SCD5ALDH1A1RAB9A

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
US-7666888-B2 Substituted azole aromatic heterocycles as inhibitors of 11β-HSD-1 AMGEN INC. (US) 2010-02-23 US disclosed
US-7666888-B2 Substituted azole aromatic heterocycles as inhibitors of 11β-HSD-1 AMGEN INC. (US) 2010-02-23 US disclosed
US-7666888-B2 Substituted azole aromatic heterocycles as inhibitors of 11β-HSD-1 AMGEN INC. (US) 2010-02-23 US disclosed
EP-2051977-A2 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF LLbeta-HSD-1 Amgen Inc. (US) 2009-04-29 EP disclosed
WO-2008011453-A2 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF LLβ-HSD-1 AMGEN INC. (US) 2008-01-24 WO disclosed
WO-2008011453-A2 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF LLβ-HSD-1 AMGEN INC. (US) 2008-01-24 WO disclosed
US-20080021022-A1 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF 11BETA-HSD-1 AMGEN INC. 2008-01-24 US disclosed
US-20080021022-A1 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF 11BETA-HSD-1 AMGEN INC. 2008-01-24 US disclosed
US-20080021022-A1 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF 11BETA-HSD-1 AMGEN INC. 2008-01-24 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-20080021022-A1 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF 11BETA-HSD-1 HSD17B1, HSD11B1, HSD17B11 SCD5 1155/4885ALDH1A1 86/4885LMNA 3047/4885

“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.