SCHEMBL27718989

SCHEMBL27718989

COCCOc1cccc(C(C)Br)c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.48
▸ TSHR P16473 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.43
▸ MAPK1 P28482 2/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ LMNA P02545 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ FBP1 P09467 1/20 0.39
▸ TAAR1 Q96RJ0 1/20 0.39
▸ SYK P43405 1/20 0.39

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
SCHEMBL10224193 0.86 KDM4E (0.62) KDM4ETSHRNPSR1MAPK1CYP1A2
SCHEMBL27708855 0.85 KDM4E (0.53) KDM4ETSHRALDH1A1LMNASMN1; SMN2
SCHEMBL27491785 0.84 KDM4E (0.46) KDM4ETSHRNPSR1MAPK1CYP1A2
SCHEMBL24233057 0.82 KDM4E (0.57) KDM4ETSHRNPSR1MAPK1CYP1A2
SCHEMBL20715700 0.81 KDM4E (0.46) KDM4ETSHRNPSR1MAPK1CYP1A2
SCHEMBL20032326 0.80 KDM4E (0.48) KDM4ETSHRNPSR1MAPK1CYP1A2
SCHEMBL15723552 0.80 MAPK1 (0.58) KDM4ETSHRNPSR1MAPK1CYP1A2
SCHEMBL24713308 0.80 KDM4E (0.44) KDM4ETSHRNPSR1MAPK1CYP1A2
SCHEMBL7263660 0.79 TRIM24 (0.43) KDM4ETSHRMAPK1LMNA
SCHEMBL28069498 0.79 ACACB (0.40) KDM4EMEN1KMT2ARECQL

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
CN-102333769-B Derivatives of 2-pyridin-2-yl-pyrazol-3 (2H) -one, preparation thereof, and therapeutic use as HIF activators SANOFI AVENTIS 2014-08-27 — — CN disclosed
CN-102333769-A Derivatives of 2-pyridin-2-yl-pyrazol-3 (2H) -one, preparation thereof, and therapeutic use as HIF activators SANOFI AVENTIS 2012-01-25 — — CN disclosed
CN-101151246-B 1-benzylindole-2-carboxamide derivatives ORGANON NV 2011-04-13 — — CN disclosed
CN-101151246-A 1-benzylindole-2-carboxamide derivatives ORGANON NV (NL) 2008-03-26 — — CN disclosed
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