SCHEMBL13476232

SCHEMBL13476232

Cc1cccc2c1OC(C)(C)C(C)C2C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
HTR2C P28335 2/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL13805574 0.81 BRD4 (0.35) BRD4CREBBPHTR2CMEN1ALDH1A1
SCHEMBL14430676 0.76
SCHEMBL4970354 0.71 SLC6A2 (0.36) HTR2C
SCHEMBL11140420 0.70 CREBBP (0.39) BRD4CREBBPHTR2CALDH1A1
SCHEMBL14934302 0.69 BRD4 (0.37) BRD4CREBBPHTR2CMEN1ALDH1A1
SCHEMBL18469497 0.69 BRD4 (0.32) BRD4CREBBPHTR2C
SCHEMBL14416706 0.65 BRD4 (0.39) BRD4CREBBPHTR2CMEN1ALDH1A1
SCHEMBL18469576 0.64 BRD4 (0.33) BRD4CREBBPHTR2CMEN1ALDH1A1
SCHEMBL11001512 0.62 ACHE (0.39) MEN1ALDH1A1KMT2A
SCHEMBL90936 0.62 ADRA2A (0.35) BRD4CREBBPHTR2CMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010018867-A1 DI-SUBSTITUTED BENZOPYRANE COMPOUND 日産化学工業株式会社 (JP) 2010-02-18 WO disclosed