SCHEMBL13700533

SCHEMBL13700533

NC(=O)c1ccc2nn(-c3cc(CCO)cc(C=CC(=O)c4ccccc4)c3O)nc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.38
NPC1 O15118 5/20 0.36
RAB9A P51151 5/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
HPGD P15428 4/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
ALDH1A1 P00352 4/20 0.34
MAPT P10636 3/20 0.34
KDM4E B2RXH2 3/20 0.34
MEN1 O00255 1/20 0.34
CASP3 P42574 1/20 0.34
KMT2A Q03164 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
CDC25A P30304 1/20 0.34
CDC25C P30307 1/20 0.34
PTGS1 P23219 2/20 0.33

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
SCHEMBL13700517 0.92 TYR (0.40) TYRNPC1RAB9ANFKB1NFKB2
SCHEMBL13700511 0.91 TYR (0.43) TYRNPC1RAB9ANFKB1NFKB2
SCHEMBL13700528 0.88 CYP4F2 (0.42) TYRNPC1RAB9ANFKB1NFKB2
SCHEMBL13700535 0.88 MAPT (0.42) TYRNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL13699459 0.88 GRM5 (0.40) TYRNPC1RAB9ANFKB1NFKB2
SCHEMBL13699493 0.87 TYR (0.40) TYRNPC1RAB9ANFKB1NFKB2
SCHEMBL13700526 0.87 RAB9A (0.40) TYRNPC1RAB9ANFKB1NFKB2
SCHEMBL13700519 0.87 NPC1 (0.39) TYRNPC1RAB9ANFKB1NFKB2
SCHEMBL13700530 0.87 MAPT (0.38) TYRNPC1RAB9ANFKB1NFKB2
SCHEMBL13699489 0.85 TYR (0.37) TYRNPC1RAB9ANFKB1NFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324399-B2 Heat resistance improver and reversible thermosensitive recording medium RICOH COMPANY, LTD. (JP) 2012-12-04 US disclosed
US-20090239747-A1 HEAT RESISTANCE IMPROVER AND REVERSIBLE THERMOSENSITIVE RECORDING MEDIUM RICOH COMPANY, LTD. (JP) 2009-09-24 US disclosed