SCHEMBL396597

SCHEMBL396597

C=C(Cc1ccc(S(=O)(=O)NCC)cc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.60
LMNA P02545 3/20 0.55
TSHR P16473 1/20 0.54
KMT2A Q03164 3/20 0.51
MEP1B Q16820 1/20 0.48
POLB P06746 1/20 0.47
CYP2C9 P11712 1/20 0.46
TBXA2R P21731 1/20 0.45
NPC1 O15118 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL394859 0.88 CA12 (0.53) ALDH1A1LMNATSHRKMT2AMEP1B
SCHEMBL397044 0.86 LMNA (0.56) ALDH1A1LMNATSHRKMT2APOLB
SCHEMBL395695 0.84 SMN1; SMN2 (0.46) ALDH1A1LMNAMEP1BNPC1KDM4E
SCHEMBL166809 0.84 ALDH1A1 (0.71) ALDH1A1LMNATSHRKMT2AMEP1B
SCHEMBL392888 0.83 ALDH1A1 (0.45) ALDH1A1LMNAKMT2A
SCHEMBL398265 0.81 ALDH1A1 (0.49) ALDH1A1LMNATSHRPOLBCYP2C9
SCHEMBL397228 0.80 SMN1; SMN2 (0.56) ALDH1A1LMNAPOLBCYP2C9GAA
SCHEMBL16801098 0.80 ALDH1A1 (0.72) ALDH1A1LMNATSHRKMT2AMEP1B
SCHEMBL8490338 0.79 AKR1C3 (0.46)
SCHEMBL12440455 0.78 ALDH1A1 (0.60) ALDH1A1LMNATSHRKMT2ACYP2C9

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
US-8101332-B2 Negative-working lithographic printing plate precursor and method of lithographic printing using same FUJIFILM CORPORATION (JP) 2012-01-24 US disclosed
US-20090246688-A1 NEGATIVE-WORKING LITHOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF LITHOGRAPHIC PRINTING USING SAME FUJIFILM CORPORATION (JP) 2009-10-01 US disclosed
EP-2105298-A1 Negative-working lithographic printing plate precursor and method of lithographic printing using same Fujifilm Corporation (JP) 2009-09-30 EP disclosed