SCHEMBL9164792

SCHEMBL9164792

O=C(O)c1cccc(NC(=O)c2cc(C(=O)Nc3cccc(C(=O)O)c3)c(C(=O)O)cc2C(=O)O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
NPC1 O15118 5/20 0.62
RAB9A P51151 5/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
HTT P42858 1/20 0.62
HPSE Q9Y251 1/20 0.62
PKM P14618 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
KCNK3 O14649 1/20 0.58
KCNK9 Q9NPC2 1/20 0.58
NR1H4 Q96RI1 1/20 0.57
ALDH1A1 P00352 1/20 0.57
CA12 O43570 1/20 0.56
CA2 P00918 1/20 0.56
CA9 Q16790 1/20 0.56
MITF O75030 1/20 0.55
TP53 P04637 1/20 0.55
NFKB1 P19838 1/20 0.55
NFKB2 Q00653 1/20 0.55

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
SCHEMBL9161426 1.00 MEN1 (0.66) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL9157180 0.94 HPSE (0.68) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL9161502 0.94 HPSE (0.68) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL29204765 0.90 HPSE (0.63) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2058337 0.88 ALDH1A1 (0.71) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL6852858 0.88 MEN1 (0.60) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL6848435 0.87 MEN1 (0.63) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL30488668 0.87 KMT2A (0.62) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL9164932 0.86 RAB9A (0.73) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL23796591 0.85 KMT2A (0.60) MEN1KMT2ANPC1RAB9ASMN1; SMN2

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-0342652-B1 Thermoplastic wholly aromatic copolyimide ester and process for producing the same IDEMITSU PETROCHEMICAL CO (JP) 1995-03-08 EP disclosed
US-5003030-A Thermoplastic wholly aromatic copolyimide ester and process for producing the same IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1991-03-26 US disclosed
EP-0342652-A2 Thermoplastic wholly aromatic copolyimide ester and process for producing the same IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1989-11-23 EP disclosed