SCHEMBL12693366

SCHEMBL12693366

CC/C=C\c1c(C)n(/C(C)=C/C=C(/C)CC)c2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.33
▸ MEN1 O00255 4/20 0.32
▸ KMT2A Q03164 4/20 0.32
▸ USP2 O75604 2/20 0.31
▸ APOBEC3G Q9HC16 2/20 0.31
▸ APOBEC3A P31941 1/20 0.31
▸ TNNI3 P19429 1/20 0.31
▸ TNNT2 P45379 1/20 0.31
▸ TNNC1 P63316 1/20 0.31
▸ GPR35 Q9HC97 1/20 0.31
▸ GPR55 Q9Y2T6 1/20 0.31
▸ TDP1 Q9NUW8 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
SCHEMBL21913561 0.73 POLB (0.31) POLB
SCHEMBL23799224 0.72 MEN1 (0.33) MEN1KMT2AUSP2APOBEC3GAPOBEC3A
SCHEMBL21913072 0.72 TSHR (0.50) POLBMEN1KMT2ATDP1
SCHEMBL22841435 0.72 KDM4E (0.46) MEN1KMT2A
SCHEMBL26232818 0.71 POLB (0.36) POLBMEN1KMT2AUSP2APOBEC3G
SCHEMBL20172309 0.71 MEN1 (0.38) MEN1KMT2AUSP2APOBEC3GAPOBEC3A
SCHEMBL18892113 0.68 HDAC6 (0.38) MEN1KMT2A
SCHEMBL24578600 0.64 RORC (0.35) MEN1KMT2A
SCHEMBL19087050 0.63 POLB (0.53) POLBMEN1KMT2A
SCHEMBL18919155 0.62 NPC1 (0.45) USP2TDP1

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
EP-2502908-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME Idemitsu Kosan Co., Ltd. (JP) 2012-09-26 — — EP disclosed
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