SCHEMBL12090477

SCHEMBL12090477

C=CC(=O)OCCCCCCc1ccc(C(=O)Oc2ccc(CCc3ccc(OC)cc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.53
MAPT P10636 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
NAAA Q02083 1/20 0.44
KMT2A Q03164 3/20 0.43
GFER P55789 1/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.43
CYP3A4 P08684 1/20 0.43
THRA P10827 3/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
HPGD P15428 2/20 0.41

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
SCHEMBL17146872 0.99 THRB (0.54) THRBMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL18826736 0.94 MAPT (0.47) THRBMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL14907448 0.94 THRB (0.56) THRBMAPTSMN1; SMN2NPC1KMT2A
SCHEMBL22451142 0.93 THRB (0.57) THRBMAPTSMN1; SMN2NPC1KMT2A
SCHEMBL17364495 0.90 THRB (0.53) THRBMAPTSMN1; SMN2NPC1KMT2A
SCHEMBL14000685 0.90 THRB (0.53) THRBMAPTSMN1; SMN2NPC1KMT2A
SCHEMBL12534480 0.89 MAPT (0.56) THRBMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL19621716 0.89 THRB (0.57) THRBMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL24599286 0.88 LMNA (0.50) THRBMAPTSMN1; SMN2NPC1KMT2A
SCHEMBL1072168 0.88 THRB (0.51) THRBMAPTSMN1; SMN2NPC1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11248171-B2 Polymerisable LC medium and polymer film with flat optical dispersion MERCK PATENT GMBH (DE) 2022-02-15 US disclosed
EP-3548586-B1 POLYMERISABLE LC MEDIUM AND POLYMER FILM WITH FLAT OPTICAL DISPERSION MERCK PATENT GMBH (DE) 2020-09-23 EP disclosed
US-10435628-B2 Polymerisable LC medium and polymer film with negative optical dispersion MERCK PATENT GMBH (DE) 2019-10-08 US disclosed
WO-2018099883-A1 POLYMERISABLE LC MEDIUM AND POLYMER FILM WITH FLAT OPTICAL DISPERSION MERCK PATENT GMBH (DE) 2018-06-07 WO disclosed
US-20170226421-A1 POLYMERISABLE LC MEDIUM AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION MERCK PATENT GMBH (DE) 2017-08-10 US disclosed
US-20170226421-A1 POLYMERISABLE LC MEDIUM AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION MERCK PATENT GMBH (DE) 2017-08-10 US disclosed
WO-2016020035-A1 POLYMERISABLE LC MEDIUM AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION MERCK PATENT GMBH (DE) 2016-02-11 WO disclosed
US-20120224245-A1 POLYMERISABLE LC MATERIAL AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION Merck Patent Gesellschaft mit bescrankter Haftung (DE) 2012-09-06 US disclosed
US-20120224245-A1 POLYMERISABLE LC MATERIAL AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION Merck Patent Gesellschaft mit bescrankter Haftung (DE) 2012-09-06 US disclosed
WO-2011050896-A1 POLYMERISABLE LC MATERIAL AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION MERCK PATENT GMBH (DE) 2011-05-05 WO disclosed