SCHEMBL9568438

SCHEMBL9568438

CCOC(=O)c1c2n(c3c(OC)c(-c4ccc(N(C)C)cc4)c(F)cc3c1=O)CS2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
PRKCZ Q05513 2/20 0.38
RAB9A P51151 1/20 0.38
PRKCI P41743 1/20 0.38
PTPN1 P18031 1/20 0.34
ADRB2 P07550 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 3/20 0.32
USP2 O75604 1/20 0.32
ALOX15 P16050 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SIRT2 Q8IXJ6 3/20 0.32
SIRT1 Q96EB6 3/20 0.32
GPR55 Q9Y2T6 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GRM6 O15303 1/20 0.32

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
SCHEMBL9568436 0.90 PRKCZ (0.38) MEN1KMT2APRKCZRAB9APOLB
SCHEMBL9568340 0.90 MAPT (0.41) MEN1KMT2ARAB9APOLBGAA
SCHEMBL9568351 0.88 PRKCZ (0.37) MEN1KMT2APRKCZPOLBGAA
SCHEMBL9568379 0.80 PRKCZ (0.39) MEN1KMT2APRKCZRAB9AGAA
SCHEMBL9568352 0.79 MAPT (0.41) MEN1KMT2ARAB9APOLBGAA
SCHEMBL9568392 0.78 PRKCZ (0.35) MEN1KMT2APRKCZRAB9AADRB2
SCHEMBL9568336 0.78 GSK3B (0.37) POLBHPGD
SCHEMBL9568328 0.78 GSK3B (0.36)
SCHEMBL9568333 0.77 TOP1 (0.39)
SCHEMBL9523493 0.77 MEN1 (0.46) MEN1KMT2AALDH1A1HPGDHSD17B10

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-0551518-A1 QUINOLINECARBOXYLIC ACID DERIVATIVE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-07-21 EP disclosed