SCHEMBL11025929

SCHEMBL11025929

Nc1c(C(=O)O)cccc1C(=O)c1ccncc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
G6PD P11413 1/20 0.50
CASP7 P55210 1/20 0.50
CASP6 P55212 1/20 0.50
AKR1C3 P42330 3/20 0.48
NAPRT Q6XQN6 2/20 0.48
MAPT P10636 2/20 0.46
GAA P10253 1/20 0.46
KDM4E B2RXH2 1/20 0.44
KDM6B O15054 1/20 0.44
KDM4A O75164 1/20 0.44
ALDH1A1 P00352 1/20 0.44
THRB P10828 1/20 0.44
KDM4D Q6B0I6 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
UCHL1 P09936 1/20 0.44
LMNA P02545 2/20 0.43

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
SCHEMBL2690787 0.85 AKR1C3 (0.67) MEN1KMT2AG6PDCASP7CASP6
SCHEMBL8819155 0.82 ALDH1A1 (0.56) MEN1KMT2AG6PDCASP7CASP6
SCHEMBL8864740 0.82 AKR1C3 (0.73) MEN1KMT2AAKR1C3NAPRTKDM4E
SCHEMBL11037134 0.81 ABCB11 (0.52) MEN1KMT2AKDM4ELMNAABCB11
SCHEMBL342695 0.81 TYK2 (0.49) MEN1KMT2AMAPTGAAALDH1A1
SCHEMBL30038107 0.81 MEN1 (0.52) MEN1KMT2AG6PDCASP7CASP6
SCHEMBL6355277 0.81 G6PD (0.56) MEN1KMT2AG6PDCASP7CASP6
SCHEMBL28097720 0.79 AKR1C3 (0.69) MEN1KMT2AG6PDCASP7CASP6
SCHEMBL526919 0.79 G6PD (0.74) MEN1KMT2AG6PDCASP7CASP6
SCHEMBL28052811 0.78 AKR1C3 (0.67) G6PDCASP7CASP6AKR1C3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0159291-A1 Ink composition for the ink-jet printing process CIBA-GEIGY AG (CH) 1985-10-23 EP disclosed