SCHEMBL9680387

SCHEMBL9680387

NCCSC(=O)NCCc1ccccn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.54
RAB9A P51151 4/20 0.49
NPC1 O15118 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
MAPK1 P28482 1/20 0.49
CNR1 P21554 1/20 0.49
HSD11B1 P28845 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
ADORA2A P29274 1/20 0.46
ADORA1 P30542 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46

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
SCHEMBL255011 0.83 HRH3 (0.53) RAB9ANPC1MEN1KMT2AMAPK1
SCHEMBL2755853 0.77 MAPK1 (0.60) RAB9ANPC1MEN1KMT2AMAPK1
SCHEMBL30206599 0.77 MAPK1 (0.60) RAB9ANPC1MEN1KMT2AMAPK1
SCHEMBL9680393 0.77 TAS1R3 (0.54) RAB9ANPC1MEN1KMT2AMAPK1
SCHEMBL18381293 0.76 KMT2A (0.55) HRH1RAB9ANPC1MEN1KMT2A
SCHEMBL1694984 0.76 RAB9A (0.62) RAB9ANPC1MEN1KMT2AMAPK1
SCHEMBL27263888 0.76 RAB9A (0.58) RAB9ANPC1MEN1KMT2AMAPK1
SCHEMBL9680383 0.75 LMNA (0.50) RAB9ANPC1MEN1KMT2AMAPK1
SCHEMBL4575707 0.75 MAPK1 (0.65) RAB9ANPC1MEN1KMT2AMAPK1
SCHEMBL29655342 0.75 MAPK1 (0.65) RAB9ANPC1MEN1KMT2AMAPK1

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
EP-0272063-B1 MITOMYCIN DERIVATIVES KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1992-04-08 EP disclosed
US-4863935-A Mitomycin compounds having useful anti-tumor activity KYOWA HAKKO KOGYO K.K. (JP) 1989-09-05 US disclosed