SCHEMBL9693690

SCHEMBL9693690

CCCCCCc1cnc(-c2ccc(C(=O)OC)cc2)nc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 6/20 0.73
▸ SMN1; SMN2 Q16637 4/20 0.64
▸ MAPT P10636 4/20 0.64
▸ RAB9A P51151 3/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ USP2 O75604 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ NPC1 O15118 2/20 0.52
▸ NFKB1 P19838 1/20 0.52
▸ NFKB2 Q00653 1/20 0.52
▸ RELA Q04206 1/20 0.52
▸ CYP4A11 Q02928 2/20 0.51
▸ CYP4F2 P78329 1/20 0.51
▸ RARA P10276 1/20 0.50
▸ MTOR P42345 1/20 0.50

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
SCHEMBL9695133 1.00 RARB (0.73) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL9696525 1.00 RARB (0.73) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL9693545 1.00 RARB (0.73) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL9695731 0.99 RARB (0.71) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL9694892 0.94 RARB (0.64) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL6253750 0.91 RARB (0.61) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL9695073 0.89 RARB (0.56) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL9695300 0.88 RARB (0.71) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL9694826 0.88 RARB (0.71) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL9695647 0.88 RARB (0.71) RARBSMN1; SMN2MAPTRAB9AMEN1

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
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