SCHEMBL16385837

SCHEMBL16385837

O=C(C1=CCN(Cc2ccccc2)C=C1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.43
▸ KDM4E B2RXH2 1/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CYP2D6 P10635 3/20 0.37
▸ CYP2C19 P33261 3/20 0.37
▸ CYP2C9 P11712 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ CYP19A1 P11511 1/20 0.37
▸ CHRM2 P08172 1/20 0.36
▸ CHRM3 P20309 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ MDM2 Q00987 1/20 0.36
▸ AKR1B1 P15121 1/20 0.36

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
Bromide SCHEMBL28311088 0.99 ALDH1A1 (0.42) ALDH1A1KDM4EKMT2AMAPK1SMN1; SMN2
SCHEMBL27791901 0.86 GSK3A (0.37) ALDH1A1KMT2ASMN1; SMN2LMNATSHR
SCHEMBL5969762 0.84 ADRA1D (0.38) ALDH1A1KMT2ATSHRCYP2D6
Bromide SCHEMBL27854183 0.82 LMNA (0.42) ALDH1A1SMN1; SMN2LMNATSHRCYP2D6
SCHEMBL10619250 0.80 SIGMAR1 (0.36) ALDH1A1KDM4EKMT2AMEN1CYP2C19
Bromide SCHEMBL29099290 0.79 MAPT (0.41) ALDH1A1KMT2ASMN1; SMN2MEN1LMNA
SCHEMBL30462667 0.79 CYP19A1 (0.43) ALDH1A1KDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL28150086 0.78 PTGS1 (0.47) ALDH1A1KDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL27836159 0.75 LMNA (0.36) KMT2AMAPK1SMN1; SMN2LMNATSHR
SCHEMBL27763000 0.74 SIGMAR1 (0.39) KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2292430-B1 INKJET RECORDING DEVICE AND INKJET RECORDING METHOD KONICA MINOLTA HOLDINGS INC (JP) 2015-01-07 — — EP disclosed
CN-100529966-C Active energy ray sensitive resin composition, active energy ray sensitive resin film and method for forming pattern using said film MURAKAMI CO LTD (JP) 2009-08-19 — — CN disclosed
CN-1678958-A Active energy ray sensitive resin composition, active energy ray sensitive resin film and method for forming pattern using said film MURAKAMI CO LTD (JP) 2005-10-05 — — CN disclosed
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