SCHEMBL7815858

SCHEMBL7815858

CCc1ccc(-c2ccc(OCC3COC(c4c(F)cccc4F)=N3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
GRM2 Q14416 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL7812430 0.93 TAAR1 (0.37) TAAR1GRM2SMN1; SMN2MEN1KMT2A
SCHEMBL7810550 0.88 MAPT (0.43) TAAR1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL7810324 0.88 TAAR1 (0.39) TAAR1NPC1RAB9AKDM4EALDH1A1
SCHEMBL7812123 0.88 TAAR1 (0.36) TAAR1
SCHEMBL7812313 0.88 TAAR1 (0.40) TAAR1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL7810332 0.86 TAAR1 (0.37) TAAR1
SCHEMBL7809993 0.86 TAAR1 (0.46) TAAR1NPC1RAB9A
SCHEMBL7808377 0.86 NPC1 (0.46) TAAR1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL7803461 0.86 TAAR1 (0.35) TAAR1GRM2
SCHEMBL7803673 0.84 TAAR1 (0.41) TAAR1NPC1RAB9AALDH1A1LMNA

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
EP-0553623-B1 An oxazoline derivative its production and its use SUMITOMO CHEMICAL CO (JP) 2001-04-04 EP disclosed
US-5556867-A INSECTICIDES AND MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-09-17 US disclosed
EP-0553623-A1 An oxazoline derivative its production and its use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-04 EP disclosed