SCHEMBL10023970

SCHEMBL10023970

C=C(C)C(=O)Oc1ccc(-c2cc3ccc(CCCC)cc3oc2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.49
RAB9A P51151 8/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 2/20 0.49
GLA P06280 2/20 0.49
GAPDH P04406 2/20 0.48
MAOB P27338 2/20 0.46
RXFP1 Q9HBX9 2/20 0.46
MIF P14174 1/20 0.46
SIRT3 Q9NTG7 1/20 0.46
ERAP1 Q9NZ08 1/20 0.46
PTPN7 P35236 1/20 0.44
TP53 P04637 1/20 0.44
ACHE P22303 1/20 0.44
POLB P06746 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL12386524 0.97 NPC1 (0.48) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL18869474 0.91 NPC1 (0.48) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL12386525 0.91 NPC1 (0.53) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL2303014 0.90 NPC1 (0.47) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL18522409 0.90 NPC1 (0.49) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL21142059 0.89 NPC1 (0.48) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL23366546 0.88 NPC1 (0.45) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL18808120 0.88 NPC1 (0.45) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL21884777 0.87 NPC1 (0.46) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL22071979 0.87 NPC1 (0.45) NPC1RAB9AMEN1KMT2AKDM4E

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-9556382-B2 Polymerisable mixtures and the use thereof in liquid crystal displays MERCK PATENT GMBH (DE) 2017-01-31 US disclosed
US-9556382-B2 Polymerisable mixtures and the use thereof in liquid crystal displays MERCK PATENT GMBH (DE) 2017-01-31 US disclosed
EP-2596034-B1 POLYMERIZABLE MIXTURES AND THE USE THEREOF IN LIQUID CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2014-11-26 EP disclosed
EP-2340292-B1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2013-05-29 EP disclosed
US-20130114010-A1 POLYMERISABLE MIXTURES AND THE USE THEREOF IN LIQUID CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2013-05-09 US disclosed
US-20130114010-A1 POLYMERISABLE MIXTURES AND THE USE THEREOF IN LIQUID CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2013-05-09 US disclosed
WO-2012022391-A2 POLYMERIZABLE MIXTURES AND THE USE THEREOF IN LIQUID CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2012-02-23 WO disclosed
US-20110205482-A1 LIQUID-CRYSTAL DISPLAY MERCH PATENT GESELLSCHAFT MIT BESCHRANKTE HAFTUNG (DE) 2011-08-25 US disclosed
US-20110205482-A1 LIQUID-CRYSTAL DISPLAY MERCH PATENT GESELLSCHAFT MIT BESCHRANKTE HAFTUNG (DE) 2011-08-25 US disclosed
WO-2010049044-A1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2010-05-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110205482-A1 LIQUID-CRYSTAL DISPLAY VCL, LPXN, LCP1 NPC1 4181/4885RAB9A 2121/4885MEN1 2820/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.