SCHEMBL6485776

SCHEMBL6485776

CC(=O)Nc1ccc(-c2cnc(C(=O)NC3CC4CC3CN4)s2)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 16/20 0.47
USP30 Q70CQ3 1/20 0.43
ROCK1 Q13464 1/20 0.39
KIT P10721 1/20 0.38
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL6488820 0.91 NQO2 (0.45) DGAT1USP30NPC1RAB9ASMN1; SMN2
SCHEMBL6498247 0.88 USP30 (0.45) DGAT1USP30
SCHEMBL6487656 0.87 DGAT1 (0.45) DGAT1USP30ROCK1NPC1RAB9A
SCHEMBL6495134 0.86 USP30 (0.44) DGAT1USP30ROCK1
SCHEMBL6489724 0.86 USP30 (0.53) DGAT1USP30
SCHEMBL6490465 0.85 HDAC6 (0.45) DGAT1USP30
SCHEMBL6499855 0.85 HDAC1 (0.45) DGAT1USP30
SCHEMBL6490254 0.85 USP30 (0.43) DGAT1USP30ROCK1
SCHEMBL6496553 0.85 HDAC1 (0.48) DGAT1USP30NPC1SMN1; SMN2
SCHEMBL6499145 0.84 CHRNA7 (0.48) NPC1RAB9ASMN1; SMN2

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-6919359-B2 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PFIZER INC (US) 2005-07-19 US claimed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 US claimed
US-6919359-B2 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PFIZER INC (US) 2005-07-19 US disclosed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 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-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease MALT1, WFS1, NR5A1 DGAT1 2495/4885USP30 3442/4885ROCK1 2796/4885

“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.