SCHEMBL9475290

SCHEMBL9475290

Cc1cccc(C(=O)O)c1NC(=O)CSc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
POLB P06746 3/20 0.56
L3MBTL1 Q9Y468 3/20 0.54
ALDH1A1 P00352 5/20 0.54
MAPK1 P28482 1/20 0.54
TP53 P04637 1/20 0.53
PKM P14618 1/20 0.51
HTT P42858 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HSD17B10 Q99714 1/20 0.49

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
SCHEMBL5140151 0.81 POLB (0.59) LMNAMEN1KMT2APOLBALDH1A1
SCHEMBL9958891 0.79 POLB (0.60) LMNAMEN1KMT2ANPC1RAB9A
SCHEMBL14479863 0.78 ALDH1A1 (0.78) LMNAMEN1KMT2ANPC1RAB9A
SCHEMBL22406054 0.78 POLB (0.59) LMNAMEN1KMT2APOLBALDH1A1
SCHEMBL8485405 0.78 LMNA (1.00) LMNAMEN1KMT2ANPC1RAB9A
SCHEMBL9474574 0.78 POLB (0.59) LMNAMEN1KMT2ASMN1; SMN2POLB
SCHEMBL9474708 0.76 POLB (0.57) LMNAMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL9475267 0.75 HCAR2 (0.56) LMNANPC1POLBALDH1A1MAPK1
SCHEMBL9473982 0.75 KMT2A (0.75) LMNAMEN1KMT2ANPC1RAB9A
SCHEMBL4565884 0.74 HDAC3 (0.57) LMNAMEN1KMT2APOLBALDH1A1

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-5217961-A High carcinostatic activity; inhibiting KB-cell growth MECT CORPORATION (JP) 1993-06-08 US disclosed
EP-0376166-A1 Condensed quinoline system compound and process of preparation thereof MECT CORPORATION (JP) 1990-07-04 EP disclosed