SCHEMBL10508779

SCHEMBL10508779

CCN(C(=O)O)c1cccc(OC(=O)Nc2ccc(F)c(Cl)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
POLB P06746 1/20 0.47
TSHR P16473 2/20 0.47
MAPT P10636 4/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 1/20 0.44
FABP4 P15090 1/20 0.43
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
KDM4E B2RXH2 2/20 0.42
CDK8 P49336 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL11665510 0.92 BCHE (0.49) BCHEACHESMN1; SMN2NPC1RAB9A
SCHEMBL10344767 0.90 BCHE (0.52) BCHEACHESMN1; SMN2NPC1RAB9A
SCHEMBL11666505 0.90 BCHE (0.52) BCHEACHENPC1RAB9APOLB
SCHEMBL11377413 0.88 BCHE (0.58) BCHEACHESMN1; SMN2NPC1RAB9A
SCHEMBL10666880 0.86 BCHE (0.55) BCHEACHESMN1; SMN2NPC1RAB9A
SCHEMBL1828040 0.83 BCHE (0.70) BCHEACHESMN1; SMN2RAB9AMAPT
SCHEMBL11326986 0.81 ALDH1A1 (0.62) BCHEACHEMAPTMEN1KMT2A
SCHEMBL17868230 0.79 POLB (0.67) SMN1; SMN2NPC1RAB9APOLBTSHR
SCHEMBL10713942 0.79 ALDH1A1 (0.64) SMN1; SMN2NPC1RAB9APOLBTSHR
SCHEMBL11663128 0.78 BCHE (0.55) BCHEACHENPC1RAB9APOLB

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
EP-0121129-B1 2,5-DIHYDRO-5-ARYLIMINO-PYRROLES, PROCESS FOR THEIR PRODUCTION AND THEIR USES AS HERBICIDES BASF Aktiengesellschaft (DE) 1989-02-01 EP disclosed
US-4131751-A PHENYLENE, PLANT GROWTH REGULATORS BASF AKTIENGESELLSCHAFT (DE) 1978-12-26 US disclosed