SCHEMBL14515311

SCHEMBL14515311

CC(c1ccc(-c2ccc(F)cc2)cc1)n1c(=O)n(C2CCN(C(=O)C3CCN(Cc4ccnc(N)c4)CC3)CC2)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 4/20 0.67

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
SCHEMBL14515316 0.94 CYP3A4 (0.73) CYP3A4
SCHEMBL14515327 0.90 CYP3A4 (0.52) CYP3A4
SCHEMBL14515309 0.89 CYP3A4 (0.61) CYP3A4
SCHEMBL8229212 0.88 CYP3A4 (0.52) CYP3A4
SCHEMBL14515313 0.86 CYP3A4 (0.70) CYP3A4
SCHEMBL8229149 0.84 CYP3A4 (0.56) CYP3A4
SCHEMBL8229161 0.82 CYP3A4 (0.50) CYP3A4
SCHEMBL8231386 0.81 CYP3A4 (0.82) CYP3A4
SCHEMBL8420471 0.81 CYP3A4 (0.52) CYP3A4
SCHEMBL14515358 0.81 CYP3A4 (0.81) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220735-B2 Benzimidazolone histamine H3 antagonists SCHERING CORPORATION (US) 2007-05-22 — — US disclosed
US-7220735-B2 Benzimidazolone histamine H3 antagonists SCHERING CORPORATION (US) 2007-05-22 — — US disclosed
Send feedback