SCHEMBL6253750

SCHEMBL6253750

CCCCCCCCc1ccc(-c2cnc(-c3ccc(C(=O)OC)cc3)nc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 8/20 0.61
▸ MAPT P10636 3/20 0.60
▸ SMN1; SMN2 Q16637 3/20 0.60
▸ MEN1 O00255 2/20 0.58
▸ ALDH1A1 P00352 2/20 0.58
▸ KMT2A Q03164 2/20 0.58
▸ RAB9A P51151 2/20 0.58
▸ KDM4E B2RXH2 1/20 0.58
▸ USP2 O75604 1/20 0.58
▸ GAA P10253 1/20 0.58
▸ HPGD P15428 1/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ RARA P10276 1/20 0.57
▸ MTOR P42345 1/20 0.57
▸ CYP4A11 Q02928 2/20 0.55
▸ CYP4F2 P78329 1/20 0.55
▸ FAAH O00519 1/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ NFKB2 Q00653 1/20 0.49

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
SCHEMBL9688520 0.95 MAPT (0.57) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9693545 0.91 RARB (0.73) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9696525 0.91 RARB (0.73) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9695133 0.91 RARB (0.73) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9693690 0.91 RARB (0.73) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL9695731 0.90 RARB (0.71) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL2401275 0.89 RARB (0.69) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL4178997 0.89 RARB (0.69) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL20874436 0.89 RARB (0.69) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL4188800 0.89 RARB (0.69) RARBMAPTSMN1; SMN2MEN1ALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0884309-B1 Optically active compound, antiferroelectric liquid crystal composition containing the same, process for producing the same and process for producing optically active carboxylic acid SEMICONDUCTOR ENERGY LAB (JP) 2005-09-07 — — EP disclosed
US-5965059-A Optically active compound, antiferroelectric liquid crystal composition containing the same, process for producing the same and process for producing an optically active carboxylic acid TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-10-12 — — US disclosed
EP-0884309-A1 Optically active compound, antiferroelectric liquid crystal composition containing the same, process for producing the same and process for producing optically active carboxylic acid Takasago International Corporation (JP) 1998-12-16 — — EP disclosed
Send feedback