SCHEMBL14765170

SCHEMBL14765170

COc1c(Br)ccc2c1NC(=O)C(C)N2

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BRPF1 P55201 1/20 0.44
▸ CREBBP Q92793 1/20 0.44
▸ GSK3B P49841 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ TSHR P16473 1/20 0.35
▸ PLK4 O00444 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ XIAP P98170 1/20 0.32
▸ BIRC2 Q13490 1/20 0.32
▸ TP53 P04637 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.30

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
SCHEMBL24157395 0.80 BRPF1 (0.47) BRPF1CREBBPGSK3BPOLBTSHR
SCHEMBL30212596 0.80 BRPF1 (0.47) BRPF1CREBBPGSK3BPOLBTSHR
SCHEMBL24156584 0.78 BRPF1 (0.46) BRPF1CREBBPGSK3BPOLBTSHR
SCHEMBL30212561 0.78 BRPF1 (0.46) BRPF1CREBBPGSK3BPOLBTSHR
SCHEMBL24157211 0.78 BRPF1 (0.46) BRPF1CREBBPGSK3BPOLBTSHR
SCHEMBL25377725 0.75 BRPF1 (0.42) BRPF1CREBBPGSK3BPOLBTSHR
SCHEMBL31049730 0.75 BRPF1 (0.42) BRPF1CREBBPGSK3BPOLBTSHR
SCHEMBL15243711 0.74 CREBBP (0.58) BRPF1CREBBPGSK3BPOLBTSHR
SCHEMBL14765190 0.74 CREBBP (0.58) BRPF1CREBBPGSK3BPOLBTSHR
SCHEMBL15231700 0.72 CREBBP (0.46) BRPF1CREBBPGSK3BPOLBTSHR

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-2013034758-A1 SUBSTITUTED TRIAZOLOPYRAZINES AND USES THEREOF H. LUNDBECK A/S (DK) 2013-03-14 — — WO disclosed
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