SCHEMBL9587530

SCHEMBL9587530

Cc1csc(Oc2ccc(CNC(=O)c3cc(C)nn3C)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ KLKB1 P03952 1/20 0.45
▸ PHGDH O43175 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ PPARG P37231 1/20 0.43
▸ PPARD Q03181 1/20 0.43
▸ PPARA Q07869 1/20 0.43
▸ TP53 P04637 4/20 0.43
▸ MAPK14 Q16539 2/20 0.41
▸ HTT P42858 2/20 0.41
▸ MMP2 P08253 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ STAT3 P40763 1/20 0.41
▸ MMP13 P45452 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ SLC8A1 P32418 1/20 0.40

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
SCHEMBL9587380 0.83 L3MBTL1 (0.54) L3MBTL1MAPTMAPK14HTTMMP2
SCHEMBL9587863 0.82 SMN1; SMN2 (0.49) L3MBTL1MAPTTP53MAPK14HTT
SCHEMBL9587518 0.81 L3MBTL1 (0.53) L3MBTL1KLKB1PHGDHMAPTPPARG
SCHEMBL9474003 0.81 LMNA (0.64) L3MBTL1MAPTMAPK14HTTMMP2
SCHEMBL9198501 0.78 L3MBTL1 (0.58) L3MBTL1KLKB1PHGDHMAPTPPARG
SCHEMBL9195354 0.78 L3MBTL1 (0.64) L3MBTL1KLKB1PHGDHMAPTPPARG
SCHEMBL920314 0.76 ADORA2A (0.42) KLKB1MAPTMAPK14HTTMMP2
SCHEMBL9474220 0.75 CXCR4 (0.51) MAPTMAPK14HTTMMP2CYP3A4
SCHEMBL9473579 0.73 MAPK14 (0.39) L3MBTL1MAPTTP53MAPK14HTT
SCHEMBL921177 0.73 HPGD (0.49) MAPTCYP3A4SMN1; SMN2KDM4EALDH1A1

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-5206259-A Insecticides, acaricides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-04-27 — — US claimed
US-5206259-A Insecticides, acaricides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-04-27 — — US disclosed
Send feedback