SCHEMBL11203259

SCHEMBL11203259

CNc1ccc(SC)cc1.O=C(O)COc1nc2ccccc2o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
TP53 P04637 3/20 0.41
TSHR P16473 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
CEPT1 Q9Y6K0 2/20 0.40
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GLO1 Q04760 1/20 0.39
RXFP1 Q9HBX9 2/20 0.39
PCSK9 Q8NBP7 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
KDM1A O60341 1/20 0.38
NPC1 O15118 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
PTPN1 P18031 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
SCHEMBL11191673 0.89 ALDH1A1 (0.53) MAPTTP53TSHRALDH1A1CEPT1
SCHEMBL11174178 0.84 SMN1; SMN2 (0.41) MAPTTP53TSHRALDH1A1RAB9A
SCHEMBL2539650 0.82 MEN1 (0.50) MAPTTP53ALDH1A1RAB9AKDM4E
SCHEMBL11195632 0.76 KMT2A (0.52) MAPTALDH1A1RAB9AGLO1RXFP1
SCHEMBL11203262 0.75 ALDH1A1 (0.37) MAPTTP53TSHRALDH1A1MAOA
SCHEMBL8707412 0.73 TSHR (0.57) MAPTTP53TSHRALDH1A1CEPT1
SCHEMBL9403508 0.70 KMT2A (0.44) MAPTTP53ALDH1A1RAB9AKDM4E
SCHEMBL8861871 0.69 SMN1; SMN2 (0.46) MAPTTP53TSHRALDH1A1MAOA
SCHEMBL11547369 0.69 RAB9A (0.43) MAPTTP53ALDH1A1RAB9AKDM4E
SCHEMBL11191694 0.69 ALDH1A1 (0.43) MAPTTP53TSHRALDH1A1CEPT1

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-4384881-A Herbicidally active novel benzazol-2-yloxyacetanilides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1983-05-24 US claimed
US-4384881-A Herbicidally active novel benzazol-2-yloxyacetanilides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1983-05-24 US disclosed