SCHEMBL8990592

SCHEMBL8990592

OCCOc1cccc(C=Cc2ncnc(C(Cl)(Cl)Cl)n2)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 7/20 0.42
CYSLTR1 Q9Y271 7/20 0.42
SYK P43405 2/20 0.35
ALDH1A1 P00352 3/20 0.35
RECQL P46063 1/20 0.35
LCK P06239 1/20 0.34
TLR4 O00206 1/20 0.34
TLR2 O60603 1/20 0.34
MAOB P27338 1/20 0.34
KDM4E B2RXH2 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
P2RY12 Q9H244 1/20 0.34
FURIN P09958 1/20 0.33
PKM P14618 1/20 0.33
CHRNA7 P36544 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
SCHEMBL6838983 0.89 CYSLTR2 (0.40) CYSLTR2CYSLTR1SYKALDH1A1RECQL
SCHEMBL6838982 0.89 CYSLTR2 (0.40) CYSLTR2CYSLTR1SYKALDH1A1RECQL
SCHEMBL8413671 0.85 PPARA (0.37) ALDH1A1RECQLSMN1; SMN2PDE3BPDE3A
SCHEMBL3430942 0.78 CYSLTR2 (0.39) CYSLTR2CYSLTR1ALDH1A1LCKTLR4
SCHEMBL5187666 0.76 AHR (0.38) CYSLTR1MAOBCHRNA7
SCHEMBL940015 0.75 KDM4E (0.44) ALDH1A1KDM4ESMN1; SMN2PKM
SCHEMBL940017 0.75 KDM4E (0.44) ALDH1A1KDM4ESMN1; SMN2PKM
SCHEMBL8021069 0.74 PPARA (0.38) ALDH1A1RECQLSMN1; SMN2CHRNA7
SCHEMBL195709 0.74 PPARA (0.38) ALDH1A1RECQLSMN1; SMN2CHRNA7
SCHEMBL5186874 0.73 ESR1 (0.41) ALDH1A1KDM4ESMN1; SMN2CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5484919-A Migration-resistant halomethyl-1,3,5-triazine photoinitiator MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-01-16 US disclosed