SCHEMBL8060074

SCHEMBL8060074

CC=Cc1cc(C)cc(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.41
CNR2 P34972 1/20 0.39
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
CYP3A4 P08684 3/20 0.37
TP53 P04637 2/20 0.37
LMNA P02545 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.35
ALOX5 P09917 2/20 0.34
PTGS1 P23219 2/20 0.34
PTGS2 P35354 2/20 0.34
TYR P14679 1/20 0.34
TDP1 Q9NUW8 1/20 0.32
ACHE P22303 1/20 0.32
APLNR P35414 1/20 0.31
NPC1 O15118 1/20 0.31
CASP3 P42574 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31

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
SCHEMBL3692946 0.84 ALDH1A1 (0.44) ALDH1A1TSHRTP53ALOX5PTGS1
SCHEMBL3692947 0.84 ALDH1A1 (0.44) ALDH1A1TSHRTP53ALOX5PTGS1
SCHEMBL16956200 0.83 APP (0.36) NOS2CNR2ALDH1A1TSHRCYP3A4
SCHEMBL16962236 0.83 PTGS1 (0.45) NOS2CNR2ALDH1A1TSHRCYP3A4
SCHEMBL13369584 0.79 CYP1A1 (0.58) ALDH1A1TSHRCYP3A4TP53LMNA
SCHEMBL19968585 0.79 ALDH1A1 (0.40) ALDH1A1TSHRTP53ALOX5PTGS1
SCHEMBL29350410 0.79 ALDH1A1 (0.40) ALDH1A1TSHRTP53ALOX5PTGS1
SCHEMBL21399871 0.78 NFE2L2 (0.43) NOS2PTGS1CYP1A1CYP1B1
SCHEMBL19166263 0.78 NFE2L2 (0.43) NOS2PTGS1CYP1A1CYP1B1
SCHEMBL38650753 0.77 ALDH1A1 (0.38) ALDH1A1TSHRTP53ALOX5PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106847691-A A kind of rectification diode cleaning method 安徽兆利光电科技有限公司 2017-06-13 CN claimed
CN-109265588-B Fluorine-containing polymer and method for producing same 北京航天爱锐科技有限责任公司 2020-12-18 CN disclosed
CN-109265588-A Fluoropolymer and preparation method thereof 北京航天爱锐科技有限责任公司 2019-01-25 CN disclosed
CN-106847691-A A kind of rectification diode cleaning method 安徽兆利光电科技有限公司 2017-06-13 CN disclosed
CN-102573458-B Monoalkyl sulfosuccinates in pesticide formulations and applications as hydrotropes AKZO NOBEL CHEMICALS INT BV 2015-05-27 CN disclosed
CN-103547149-B Acrylate-acrylamide-AMPS terpolymers as dispersants for agrochemical formulations BASF SE 2015-04-08 CN disclosed
CN-103547149-A Acrylate-acrylamide-AMPS terpolymers as dispersants for agrochemical formulations BASF SE 2014-01-29 CN disclosed
CN-101657095-B Water-suspendable agricultural chemical composition SYNGENTA PARTICIPATIONS AG 2013-11-13 CN disclosed
US-6057336-A ANTIINFLAMMATORY AGENTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-02 US disclosed