SCHEMBL9285175

SCHEMBL9285175

CSc1ccc2c(c1)c(O)c(C(=O)O)c(=S)n2C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.41
▸ DHODH Q02127 1/20 0.38
▸ KDM4E B2RXH2 5/20 0.35
▸ AKR1C3 P42330 3/20 0.35
▸ AKR1C2 P52895 3/20 0.35
▸ EGFR P00533 2/20 0.35
▸ ALDH1A1 P00352 5/20 0.34
▸ MAPT P10636 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ SRC P12931 1/20 0.33
▸ GAA P10253 2/20 0.33
▸ LDHA P00338 2/20 0.33
▸ LDHB P07195 2/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ KMT2A Q03164 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
SCHEMBL9197584 0.85 ALDH1A1 (0.47) MCL1KDM4EALDH1A1HIF1AMEN1
SCHEMBL9712308 0.83 ALDH1A1 (0.49) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL9200461 0.82 KMT2A (0.54) DHODHKDM4EEGFRALDH1A1HPGD
SCHEMBL9712333 0.75 ALDH1A1 (0.49) KDM4EEGFRALDH1A1MAPTHSD17B10
SCHEMBL15154503 0.72 MEN1 (0.59) KDM4EEGFRALDH1A1MAPTHPGD
SCHEMBL9287103 0.71 MEN1 (0.57) KDM4EEGFRALDH1A1HIF1ASRC
SCHEMBL9202310 0.71 MEN1 (0.71) KDM4EEGFRALDH1A1HIF1ASRC
SCHEMBL9273846 0.71 ALDH1A1 (0.66) KDM4EALDH1A1HPGDGAAMEN1
SCHEMBL9201791 0.70 KMT2A (0.54) KDM4EALDH1A1HPGDHIF1ASRC
SCHEMBL21375760 0.70 FGFR1 (0.42) MCL1KDM4EAKR1C3AKR1C2ALDH1A1

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-0639182-A1 QUINOLINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-02-22 — — EP disclosed
WO-1992018483-A1 QUINOLINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-10-29 — — WO disclosed
Send feedback