SCHEMBL27919443

SCHEMBL27919443

CCc1cc(-c2ccccc2)c2c3cc(Br)ccc3n(Cc3ccccc3)c2c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 2/20 0.47
▸ MAPK8 P45983 6/20 0.44
▸ TSPO P30536 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ CYP19A1 P11511 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CFTR P13569 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ PIK3R1 P27986 1/20 0.38
▸ PIK3CA P42336 1/20 0.38
▸ HTT P42858 1/20 0.38

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
SCHEMBL27901718 0.86 CYP19A1 (0.53) PLA2G2ACYP19A1KMT2A
SCHEMBL31222301 0.77 CYP19A1 (0.60) PLA2G2ATSPONPC1CYP19A1LMNA
SCHEMBL2244878 0.77 CYP19A1 (0.60) PLA2G2ATSPONPC1CYP19A1LMNA
SCHEMBL27919449 0.77 NLRP3 (0.45) MAPK8LMNAKMT2AHTT
SCHEMBL17969632 0.75 NPC1 (0.51) PLA2G2ATSPONPC1CYP19A1LMNA
SCHEMBL2246814 0.73 CYP19A1 (0.70) PLA2G2ATSPONPC1CYP19A1KMT2A
SCHEMBL3855156 0.72 GRIK2 (0.50) PLA2G2AMAPK8NPC1CYP19A1LMNA
SCHEMBL8173916 0.71 CYP19A1 (0.57) PLA2G2ATSPONPC1CYP19A1KMT2A
SCHEMBL3854526 0.70 PLA2G2A (0.59) PLA2G2ANPC1LMNAKMT2APPARG
SCHEMBL6920117 0.69 CA12 (0.48) PLA2G2AMAPK8TSPONPC1CYP19A1

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
CN-103044313-A Method for synthesising carbazole compounds UNIV ZHEJIANG 2013-04-17 — — CN disclosed
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