SCHEMBL9795461

SCHEMBL9795461

CCOC(=O)c1sc(C(C)C)nc1Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ KDM4E B2RXH2 4/20 0.51
▸ HTT P42858 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ CYP1A2 P05177 2/20 0.44
▸ CYP2C9 P11712 2/20 0.44
▸ CYP2C19 P33261 2/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ HSP90AA1 P07900 1/20 0.43
▸ CRHBP P24387 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ F10 P00742 2/20 0.42
▸ KDR P35968 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
SCHEMBL9795501 0.87 MAPT (0.56) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL9795496 0.85 MAPT (0.54) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL9795499 0.84 MAPT (0.53) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL9795475 0.83 MAPT (0.65) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL9795520 0.82 MAPT (0.42) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL9795390 0.79 USP10 (0.41) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL29098641 0.74 KDM4E (0.54) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL30345112 0.74 KDM4E (0.54) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL7375948 0.73 KDM4E (0.57) MEN1KMT2AKDM4EHTTSMN1; SMN2
SCHEMBL9795365 0.73 CYP1A2 (0.49) MAPTMEN1KMT2AKDM4EHTT

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-5057142-A Herbicidal thiazolecarboxamide derivatives BAYER AKTIENGESELLSCHAFT (DE) 1991-10-15 — — US disclosed
EP-0422470-A2 Thiazolcarboxylic acid amide derivatives BAYER AG (DE) 1991-04-17 — — EP disclosed
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