SCHEMBL13700528

SCHEMBL13700528

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
P4HB P07237 4/20 0.41
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 6/20 0.38
RAB9A P51151 6/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 3/20 0.38
EHMT2 Q96KQ7 1/20 0.38
HSP90AA1 P07900 1/20 0.37
HPGD P15428 3/20 0.37
LMNA P02545 2/20 0.36
TYR P14679 1/20 0.36
BCHE P06276 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
SCHEMBL13700526 0.92 RAB9A (0.40) CYP4F2CYP4A11MEN1KMT2ANPC1
SCHEMBL13700517 0.90 TYR (0.40) P4HBMEN1KMT2ANPC1RAB9A
SCHEMBL13700511 0.89 TYR (0.43) POLBPKMKMT2ANPC1RAB9A
SCHEMBL13700519 0.88 NPC1 (0.39) MEN1POLBKMT2ANPC1RAB9A
SCHEMBL13700533 0.88 TYR (0.38) MEN1POLBKMT2ANPC1RAB9A
SCHEMBL13700530 0.88 MAPT (0.38) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL13700535 0.88 MAPT (0.42) MEN1POLBBLMKMT2ATDP1
SCHEMBL13700537 0.86 CYP4F2 (0.37) CYP4F2CYP4A11P4HBMEN1POLB
SCHEMBL13699479 0.86 TYR (0.38) POLBTDP1NPC1RAB9ASMN1; SMN2
SCHEMBL13699459 0.85 GRM5 (0.40) PKMNPC1RAB9AMAPTALDH1A1

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