SCHEMBL9502947

SCHEMBL9502947

C=CCOCCCCCCCCOc1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.51
LTA4H P09960 3/20 0.45
MGAM O43451 3/20 0.41
GAA P10253 3/20 0.41
SI P14410 3/20 0.41
MGAM2 Q2M2H8 3/20 0.41
ALDH2 P05091 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
HDAC1 Q13547 4/20 0.40
HDAC2 Q92769 4/20 0.40
HDAC3 O15379 3/20 0.40
HDAC4 P56524 3/20 0.40
HDAC7 Q8WUI4 3/20 0.40
HDAC10 Q969S8 3/20 0.40
HDAC11 Q96DB2 3/20 0.40
HDAC8 Q9BY41 3/20 0.40
HDAC6 Q9UBN7 3/20 0.40
HDAC9 Q9UKV0 3/20 0.40
HDAC5 Q9UQL6 3/20 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
SCHEMBL12730987 0.94 NR5A1 (0.53) NR5A1LTA4HMGAMGAASI
SCHEMBL12926342 0.89 APP (0.49) NR5A1LTA4HMGAMGAASI
SCHEMBL5096539 0.84 NR5A1 (0.54) NR5A1LTA4HALDH2MAOAMAOB
SCHEMBL12926348 0.83 APP (0.53) NR5A1LTA4HMGAMGAASI
SCHEMBL10448325 0.82 RARB (0.63) HTTRARB
SCHEMBL9448789 0.82 RARB (0.63) HTTRARB
SCHEMBL9448769 0.82 RARB (0.63) HTTRARB
SCHEMBL14004238 0.81 RARB (0.41) LTA4HRARB
SCHEMBL3421079 0.81 GAA (0.55) LTA4HMGAMGAASIMGAM2
SCHEMBL4538565 0.80 MMP3 (0.51) HDAC1HDAC2

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-0348873-B1 FERROELECTRIC LIQUID-CRYSTALLINE POLYMER AND EPOXIDE USABLE FOR PREPARING THE FERROELECTRIC LIQUID-CRYSTALLINE POLYMER IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-06-09 EP disclosed
US-4954600-A HIGH SPEED DISPLAY IDEMITSU KOSAN CO., LTD. (JP) 1990-09-04 US disclosed
EP-0348873-A2 Ferroelectric liquid-crystalline polymer and epoxide usable for preparing the ferroelectric liquid-crystalline polymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-01-03 EP disclosed