SCHEMBL11243833

SCHEMBL11243833

CCCCCCCCc1ccc(N(c2ccc(CCCCCCCC)cc2)C2(c3ccc(N(CC)CC)cc3)OC(=O)c3cnccc32)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 8/20 0.37
CNR2 P34972 6/20 0.35
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
CRHBP P24387 1/20 0.33
CYP2C19 P33261 1/20 0.33
CRHR2 Q13324 1/20 0.33
POLB P06746 1/20 0.33
NPC1 O15118 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32

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
SCHEMBL11243411 0.93 TRPV1 (0.37) TRPV1CNR2TDP1L3MBTL1MEN1
SCHEMBL11245434 0.87 TRPV1 (0.35) TRPV1CNR2TDP1L3MBTL1CYP2C19
SCHEMBL9462507 0.87 CYP2C19 (0.41) CNR2TDP1L3MBTL1MEN1KMT2A
SCHEMBL11230933 0.86 MEN1 (0.35) CNR2TDP1L3MBTL1MEN1KMT2A
SCHEMBL11239324 0.80 TRPV1 (0.35) TRPV1CNR2TDP1L3MBTL1CYP2C19
SCHEMBL11239963 0.79 CNR2 (0.36) TRPV1CNR2MEN1KMT2AALDH1A1
SCHEMBL1882657 0.78 KMT2A (0.42) CNR2TDP1L3MBTL1MEN1KMT2A
SCHEMBL11242157 0.78 MEN1 (0.35) TDP1L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL11367710 0.78 MAPT (0.42) CNR2MEN1KMT2AALDH1A1HPGD
SCHEMBL11373082 0.77 ALDH1A1 (0.51) CNR2TDP1L3MBTL1MEN1KMT2A

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-4337340-A FROM DIPHENYLAMINES AND BENZOYL OR 3-INDOLYLCARBONYL PYRIDINE- OR PYRAZINECARBOXYLIC ACIDS STERLING DRUG INC. (US) 1982-06-29 US disclosed
US-4243250-A FUROPYRIDINONES OR FUROPYRAZINONES AS COLOR FORMERS STERLING DRUG INC. (US) 1981-01-06 US disclosed
US-4211872-A COLOR FORMERS FREEDOM CHEMICAL COMPANY 1980-07-08 US disclosed