SCHEMBL11233145

SCHEMBL11233145

O=C(Cl)c1nnc(-c2ccccc2)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.49
RAB9A P51151 8/20 0.49
KDM4E B2RXH2 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HDAC6 Q9UBN7 3/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 2/20 0.44
POLB P06746 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA5A P35218 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.43
GFER P55789 1/20 0.43
HDAC1 Q13547 2/20 0.42
RXFP1 Q9HBX9 2/20 0.42
CSNK2A2 P19784 1/20 0.42

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
SCHEMBL11231009 0.96 RAB9A (0.46) NPC1RAB9AKDM4ESMN1; SMN2HDAC6
SCHEMBL11522021 0.91 HSD17B1 (0.44) NPC1RAB9AKDM4ESMN1; SMN2HDAC6
SCHEMBL11231012 0.89 HSD17B1 (0.45) NPC1RAB9AKDM4ESMN1; SMN2HDAC6
SCHEMBL8840161 0.85 NPC1 (0.51) NPC1RAB9AKDM4ESMN1; SMN2HDAC6
SCHEMBL27768576 0.85 NPC1 (0.51) NPC1RAB9AKDM4ESMN1; SMN2HDAC6
SCHEMBL20486119 0.83 NPC1 (0.54) NPC1RAB9AKDM4ESMN1; SMN2HDAC6
SCHEMBL12725592 0.82 KDM4E (0.55) NPC1RAB9AKDM4ESMN1; SMN2MEN1
SCHEMBL191761 0.81 NPC1 (0.49) NPC1RAB9AKDM4ESMN1; SMN2HDAC6
Hydrochloric Acid SCHEMBL3691522 0.80 NPC1 (0.48) NPC1RAB9AKDM4ESMN1; SMN2HDAC6
SCHEMBL11524489 0.80 CSNK2A2 (0.51) NPC1RAB9AKDM4ESMN1; SMN2HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4326065-A PLASTICS, VARNISHES, POLYESTERS EASTMAN KODAK COMPANY (US) 1982-04-20 US disclosed
US-4251433-A BENZOTRIAZOLE DERIVATIVES; FOR POLYMERS EASTMAN KODAK COMPANY (US) 1981-02-17 US disclosed
US-4236013-A ADDITIVES FOR POLYMERS EASTMAN KODAK COMPANY (US) 1980-11-25 US disclosed
US-4116928-A Heterocylic ester, ultraviolet stabilizers and their use in organic compositions EASTMAN KODAK COMPANY (US) 1978-09-26 US disclosed