SCHEMBL8947147

SCHEMBL8947147

O=C(O)c1nsc(-c2ccccc2F)n1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
RXFP1 Q9HBX9 1/20 0.42
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
DCTPP1 Q9H773 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
LDHA P00338 1/20 0.40
ACMSD Q8TDX5 1/20 0.40
MAOA P21397 1/20 0.39
BLVRB P30043 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
EIF4E P06730 1/20 0.38
DHODH Q02127 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL8947158 0.79 ADORA3 (0.53) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL8947225 0.75 SMN1; SMN2 (0.50) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL2693403 0.75 ACHE (0.63) KDM4EALDH1A1LDHAHDAC6EIF4E
SCHEMBL8947253 0.72 NPC1 (0.46) NPC1RAB9ASMN1; SMN2PKMHPGD
SCHEMBL8840310 0.71 KDM4E (0.54) NPC1RAB9ARXFP1KDM4ESMN1; SMN2
SCHEMBL4606363 0.70 PTGS2 (0.42) KDM4EALDH1A1HPGDHTT
SCHEMBL9029245 0.69 ALDH1A1 (0.46) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL27782182 0.69 KMO (0.68) NPC1RAB9A
SCHEMBL8605221 0.69 PLK4 (0.43) NPC1RAB9AACMSDDHODH
SCHEMBL4603390 0.68 TSHR (0.42) NPC1KDM4EALDH1A1

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-5583092-A PLANT ANTIGROWTH AGENTS AMERICAN CYANAMID COMPANY (US) 1996-12-10 US disclosed
CN-1134936-A Herbicidal (1,2,4) thiadiazoles AMERICAN CYANAMID CO (US) 1996-11-06 CN disclosed
EP-0726261-A1 Herbidical 1,2,4 thiadiazoles American Cyanamid Company (US) 1996-08-14 EP disclosed
EP-0726260-A1 Herbicidal (1,2,4)thiadiazoles AMERICAN CYANAMID COMPANY (US) 1996-08-14 EP disclosed