SCHEMBL3290342

SCHEMBL3290342

O=C(O)Cl.O=C1N=C(c2ccccc2)C(c2ccccc2)O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.42
SLC6A3 Q01959 1/20 0.42
ALDH1A1 P00352 8/20 0.41
KMT2A Q03164 7/20 0.41
KDM4E B2RXH2 5/20 0.41
MAPT P10636 3/20 0.41
HPGD P15428 3/20 0.41
GAA P10253 2/20 0.41
GFER P55789 1/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 2/20 0.38
CA2 P00918 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 3/20 0.37
HTT P42858 1/20 0.36
LMNA P02545 2/20 0.36
MAPK1 P28482 1/20 0.36
NOS1 P29475 1/20 0.35
CES2 O00748 1/20 0.34
YAP1 P46937 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
SCHEMBL41171 0.93 RAB9A (0.47) RAB9ASLC6A3ALDH1A1KMT2AKDM4E
Carbamic Acid SCHEMBL6809303 0.92 RAB9A (0.45) RAB9ASLC6A3ALDH1A1KMT2AKDM4E
SCHEMBL11738724 0.83 MAOB (0.40) RAB9ASLC6A3ALDH1A1KMT2AKDM4E
SCHEMBL9769490 0.70 KDM4E (0.40) RAB9ASLC6A3ALDH1A1KMT2AKDM4E
SCHEMBL7760470 0.70 KDM4E (0.40) RAB9ASLC6A3ALDH1A1KMT2AKDM4E
SCHEMBL212810 0.69 CA2 (0.50) RAB9ASLC6A3ALDH1A1KMT2AKDM4E
SCHEMBL11740987 0.69 CYP2D6 (0.38) RAB9AALDH1A1KDM4EMAPTHPGD
SCHEMBL11728607 0.66 MAPT (0.45) ALDH1A1KMT2AKDM4EMAPTGAA
Biphenyl SCHEMBL7062651 0.65 ALDH1A1 (0.60) RAB9AALDH1A1MAPTGAASMN1; SMN2
Biphenyl SCHEMBL5071211 0.65 ALDH1A1 (0.60) RAB9AALDH1A1MAPTGAASMN1; SMN2

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
US-7727434-B2 Membranes and methods of treating membranes GENERAL ELECTRIC COMPANY (US) 2010-06-01 US disclosed
US-20070039874-A1 Membranes and methods of treating membranes GENERAL ELECTRIC COMPANY 2007-02-22 US disclosed