SCHEMBL377118

SCHEMBL377118

O=C(O)Oc1ccc(-c2ccc(OC(=O)O)cn2)nc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 3/20 0.48
P4HA1 P13674 2/20 0.48
RXFP1 Q9HBX9 1/20 0.42
CYP4F2 P78329 10/20 0.39
CYP4A11 Q02928 10/20 0.39
ALDH1A1 P00352 1/20 0.38
F2 P00734 1/20 0.38
GLA P06280 1/20 0.38
HPGD P15428 1/20 0.38
LDHA P00338 1/20 0.37
KMT2A Q03164 2/20 0.37
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL5559868 0.88 P4HTM (0.51) P4HTMCYP4A11ALDH1A1HPGDKMT2A
SCHEMBL10646167 0.83 ALDH1A1 (0.38) P4HTMRXFP1ALDH1A1F2GLA
SCHEMBL376818 0.81 MAPT (0.38) P4HTMALDH1A1F2GLAHPGD
SCHEMBL9235248 0.81 GABRP (0.53) ALDH1A1
SCHEMBL9154821 0.79 NAPRT (0.52) ALDH1A1CYP11B1CYP11B2
SCHEMBL9649805 0.79 ALDH1A1 (0.36) P4HTMALDH1A1F2GLAHPGD
SCHEMBL7866641 0.79 KMT2A (0.57) ALDH1A1F2GLAHPGDKMT2A
SCHEMBL27547712 0.76 LDHA (0.53) RXFP1ALDH1A1F2GLAHPGD
SCHEMBL465132 0.75 LMNA (0.52) ALDH1A1KMT2AMAPT
SCHEMBL9319319 0.75 P4HTM (0.35) P4HTMALDH1A1F2GLAHPGD

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 92 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2739169-B1 POROUS CATALYTIC MATRICES FOR ELIMINATION OF TOXICANTS FOUND IN TOBACCO COMBUSTION PRODUCTS MASSACHUSETTS INST TECHNOLOGY (US) 2019-06-12 EP claimed
EP-2032513-A1 PROCESS FOR PREPARING UNSATURATED HYDROCARBONS BASF SE (DE) 2009-03-11 EP claimed
WO-2007144324-A1 PROCESS FOR PREPARING UNSATURATED HYDROCARBONS BASF SE (DE) 2007-12-21 WO claimed
EP-0750602-B1 PROCESS FOR PRODUCING ALCOHOLS AND/OR ALDEHYDES BASF AG (DE) 1998-08-19 EP claimed
EP-0588225-B1 Process for the preparation of aldehydes BASF AG (DE) 1997-06-18 EP claimed
EP-0750602-A1 PROCESS FOR PRODUCING ALCOHOLS AND/OR ALDEHYDES BASF AKTIENGESELLSCHAFT (DE) 1997-01-02 EP claimed
WO-1995025080-A1 PROCESS FOR PRODUCING ALCOHOLS AND/OR ALDEHYDES BASF AKTIENGESELLSCHAFT (DE) 1995-09-21 WO claimed
EP-0588225-A2 Process for the preparation of aldehydes BASF Aktiengesellschaft (DE) 1994-03-23 EP claimed
EP-1687462-B1 METHOD FOR ELECTROCHEMICAL PRODUCTION OF A CRYSTALLINE POROUS METAL ORGANIC SKELETON MATERIAL FRAUNHOFER GES FORSCHUNG (DE) 2019-03-13 EP disclosed
EP-2798013-B1 ANTI-REFLECTIVE COATING LEIBNIZ INST FÜR NEUE MATERIALIEN GEMEINNÜTZIGE GMBH (DE) 2016-08-17 EP disclosed
EP-2168971-B1 Fluid absorption by metal-organic frameworks BASF SE (DE) 2016-08-03 EP disclosed
EP-2230288-B1 METAL-ORGANIC FRAMEWORKS IN REFRIGERATION/HEATING MACHINES BASF SE (DE) 2016-05-25 EP disclosed
EP-2408536-B1 PROCESS FOR SEPARATING ACID GASES USING AMINE IMPREGNATED METAL ORGANIC FRAMEWORKS BASF SE (DE) 2014-07-30 EP disclosed
EP-2117676-B1 METHOD FOR SEPARATING GASES USING A POROUS METAL ORGANIC FRAMEWORK MATERIAL BASF SE (DE) 2014-06-25 EP disclosed
WO-1999055675-A1 METHOD FOR THE CATALYTIC PRODUCTION OF SUBSTITUTED DIPYRIDYL DERIVATIVES AXIVA GMBH (DE) 1999-11-04 WO disclosed
EP-0750602-B1 PROCESS FOR PRODUCING ALCOHOLS AND/OR ALDEHYDES BASF AG (DE) 1998-08-19 EP disclosed
EP-0588225-B1 Process for the preparation of aldehydes BASF AG (DE) 1997-06-18 EP disclosed
EP-0750602-A1 PROCESS FOR PRODUCING ALCOHOLS AND/OR ALDEHYDES BASF AKTIENGESELLSCHAFT (DE) 1997-01-02 EP disclosed
WO-1995025080-A1 PROCESS FOR PRODUCING ALCOHOLS AND/OR ALDEHYDES BASF AKTIENGESELLSCHAFT (DE) 1995-09-21 WO disclosed
EP-0588225-A2 Process for the preparation of aldehydes BASF Aktiengesellschaft (DE) 1994-03-23 EP disclosed