SCHEMBL9817558

SCHEMBL9817558

CCCCCCCCc1ccc(C(=O)Oc2ccc(-c3ncc(CCCCCCCC)cn3)cc2F)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 11/20 0.57
▸ MAPT P10636 3/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ RARA P10276 2/20 0.50
▸ RARG P13631 1/20 0.50
▸ MEN1 O00255 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ USP2 O75604 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ MTOR P42345 1/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ NFKB2 Q00653 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ THRB P10828 2/20 0.43

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
SCHEMBL10551425 1.00 RARB (0.57) RARBMAPTSMN1; SMN2RARARARG
SCHEMBL10549824 1.00 RARB (0.57) RARBMAPTSMN1; SMN2RARARARG
SCHEMBL9817526 0.94 RARB (0.60) RARBMAPTSMN1; SMN2RARARARG
SCHEMBL10552017 0.94 RARB (0.60) RARBMAPTSMN1; SMN2RARARARG
SCHEMBL10553286 0.94 RARB (0.60) RARBMAPTSMN1; SMN2RARARARG
SCHEMBL10551863 0.94 RARB (0.60) RARBMAPTSMN1; SMN2RARARARG
SCHEMBL10548640 0.94 RARB (0.60) RARBMAPTSMN1; SMN2RARARARG
SCHEMBL10551092 0.94 RARB (0.60) RARBMAPTSMN1; SMN2RARARARG
SCHEMBL10554013 0.94 RARB (0.60) RARBMAPTSMN1; SMN2RARARARG
SCHEMBL10551055 0.94 RARB (0.60) RARBMAPTSMN1; SMN2RARARARG

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-5055221-A Rapidly switching ferroelectric display element MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-10-08 — — US disclosed
US-4820839-A LIQUID CRYSTALS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-04-11 — — US disclosed
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