SCHEMBL9695731

SCHEMBL9695731

CCCCCc1cnc(-c2ccc(C(=O)OC)cc2)nc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 6/20 0.71
▸ SMN1; SMN2 Q16637 3/20 0.65
▸ MAPT P10636 3/20 0.65
▸ RAB9A P51151 2/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ NFKB2 Q00653 1/20 0.53
▸ RELA Q04206 1/20 0.53
▸ CYP4A11 Q02928 2/20 0.52
▸ CYP4F2 P78329 1/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ USP2 O75604 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ RARA P10276 1/20 0.48
▸ MTOR P42345 1/20 0.48

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
SCHEMBL9696525 0.99 RARB (0.73) RARBSMN1; SMN2MAPTRAB9ANPC1
SCHEMBL9693545 0.99 RARB (0.73) RARBSMN1; SMN2MAPTRAB9ANPC1
SCHEMBL9695133 0.99 RARB (0.73) RARBSMN1; SMN2MAPTRAB9ANPC1
SCHEMBL9693690 0.99 RARB (0.73) RARBSMN1; SMN2MAPTRAB9ANPC1
SCHEMBL9694892 0.96 RARB (0.64) RARBSMN1; SMN2MAPTRAB9ANPC1
SCHEMBL9695073 0.90 RARB (0.56) RARBSMN1; SMN2MAPTRAB9ANPC1
SCHEMBL6253750 0.90 RARB (0.61) RARBSMN1; SMN2MAPTRAB9ANPC1
SCHEMBL9695222 0.88 RARB (0.69) RARBSMN1; SMN2MAPTRAB9ANPC1
SCHEMBL9695315 0.86 RARB (0.67) RARBSMN1; SMN2MAPTRAB9ANPC1
SCHEMBL9694826 0.86 RARB (0.71) RARBSMN1; SMN2MAPTRAB9ANPC1

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-5124068-A Liquid crystal displays MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-06-23 — — US disclosed
US-5043093-A Liquid crystals MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-08-27 — — US disclosed
Send feedback