SCHEMBL8423627

SCHEMBL8423627

CC1CN(c2cccc(Cl)c2)C(=N)S1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.45
TP53 P04637 1/20 0.44
DRD2 P14416 2/20 0.40
DRD3 P35462 2/20 0.40
KCNH2 Q12809 2/20 0.40
GRM2 Q14416 1/20 0.40
FADS1 O60427 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
HTR3A P46098 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 1/20 0.39
LMNA P02545 1/20 0.39
ALOX12 P18054 1/20 0.39

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
SCHEMBL9494260 0.81 GRM2 (0.43) ALOX5DRD2DRD3KCNH2GRM2
SCHEMBL8425507 0.76 NOTUM (0.43) DRD2DRD3KCNH2
SCHEMBL10804834 0.75 POLB (0.44) TP53KMT2AGAAALDH1A1MAPT
SCHEMBL8424267 0.72 ALOX5 (0.39) ALOX5TP53GRM2FADS1MEN1
SCHEMBL10803755 0.72 KMT2A (0.37) TP53KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL9482008 0.72 ALDH1A1 (0.49) MEN1KMT2AGAAALDH1A1MAPT
SCHEMBL9482012 0.72 ALDH1A1 (0.49) MEN1KMT2AGAAALDH1A1MAPT
SCHEMBL8428110 0.71 ALOX5 (0.39) ALOX5TP53DRD2DRD3KCNH2
SCHEMBL8427942 0.69 ALOX5 (0.40) ALOX5TP53DRD2DRD3KCNH2
SCHEMBL10983305 0.68 DRD2 (0.49) ALOX5DRD2DRD3KCNH2GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0636616-B1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL CO (JP) 1999-10-27 EP disclosed
US-5484933-A Process for production of fluoroalkane carboxamide derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-01-16 US disclosed
EP-0636616-A1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-01 EP disclosed