SCHEMBL9532579

SCHEMBL9532579

CCc1nc(CC)c(C(=O)NC(C#N)c2ccco2)s1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
NPC1 O15118 3/20 0.37
ALDH1A1 P00352 8/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 2/20 0.35
HSD17B10 Q99714 1/20 0.35
KDR P35968 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PHGDH O43175 1/20 0.33
MAPK1 P28482 1/20 0.33
POLB P06746 1/20 0.33
DNMT1 P26358 1/20 0.33

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
SCHEMBL8799762 0.89 MEN1 (0.39) RAB9AMEN1KMT2ANPC1ALDH1A1
SCHEMBL8799757 0.77 LMNA (0.51) RAB9AMEN1KMT2ANPC1ALDH1A1
SCHEMBL9528349 0.76 ALDH1A1 (0.51) RAB9AMEN1KMT2AALDH1A1TSHR
SCHEMBL8799758 0.71 CTSV (0.33) RAB9AMEN1KMT2ANPC1ALDH1A1
SCHEMBL9755465 0.71 HSD11B1 (0.36) RAB9AMEN1KMT2ANPC1ALDH1A1
SCHEMBL9644142 0.70 ALDH1A1 (0.53) RAB9AMEN1KMT2AALDH1A1MAPT
SCHEMBL9345773 0.70 KMT2A (0.42) RAB9AMEN1KMT2ANPC1ALDH1A1
SCHEMBL10665838 0.70 CTSV (0.46) RAB9AMEN1KMT2ANPC1ALDH1A1
SCHEMBL8798660 0.70 RAB9A (0.39) RAB9AMEN1KMT2ANPC1ALDH1A1
SCHEMBL10922453 0.69 SMN1; SMN2 (0.46) MEN1KMT2AALDH1A1MAPTHPGD

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
EP-0313091-B1 AMIDE DERIVATIVES, PROCESSES FOR PRODUCTION THEREOF, AND AGRICULTURAL-HORTICULTURAL FUNGICIDE CONTAINING THEM MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-09-01 EP disclosed
US-5104886-A Syntergistic mixtures of amide substituted thiazoles and other fungicides MITSUI TOATSU CHEMICALS, INC. (JP) 1992-04-14 US disclosed
US-4980363-A CONTROLLING PLANT DISEASES MITSUI TOATSU CHEMICALS, INC. (JP) 1990-12-25 US disclosed
EP-0313091-A2 Amide derivatives, processes for production thereof, and agricultural-horticultural fungicide containing them MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-04-26 EP disclosed