SCHEMBL1847342

SCHEMBL1847342

CC(OC(=O)OC(C)c1ccccc1C#N)c1ccccc1C#N

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.43
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 4/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 3/20 0.39
TSHR P16473 2/20 0.38
MAPT P10636 1/20 0.38
CASR P41180 1/20 0.37
KCNA5 P22460 1/20 0.37
HPGD P15428 1/20 0.35
KDM4E B2RXH2 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
SCHEMBL514813 0.87 L3MBTL1 (0.41) L3MBTL1MAPK1SMN1; SMN2ALDH1A1LMNA
SCHEMBL8595323 0.84 TSHR (0.49) L3MBTL1MAPK1SMN1; SMN2ALDH1A1LMNA
Hydrochloric Acid SCHEMBL27776753 0.83 L3MBTL1 (0.38) L3MBTL1MAPK1SMN1; SMN2ALDH1A1LMNA
SCHEMBL6684454 0.83 MAPK1 (0.41) L3MBTL1MAPK1SMN1; SMN2ALDH1A1LMNA
SCHEMBL4076550 0.79 TSHR (0.41) L3MBTL1MAPK1SMN1; SMN2ALDH1A1LMNA
SCHEMBL7050570 0.75 L3MBTL1 (0.45) L3MBTL1MAPK1SMN1; SMN2ALDH1A1LMNA
SCHEMBL31561697 0.75 L3MBTL1 (0.45) L3MBTL1MAPK1SMN1; SMN2ALDH1A1LMNA
SCHEMBL4314225 0.74 GABRA1 (0.54) SMN1; SMN2ALDH1A1LMNATSHRMAPT
Thiobenzoic Acid SCHEMBL28556799 0.74 ALDH1A1 (0.36) L3MBTL1MAPK1SMN1; SMN2ALDH1A1LMNA
SCHEMBL2410481 0.74 L3MBTL1 (0.47) L3MBTL1MAPK1SMN1; SMN2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4138923-A1 DRUG ANTIBODY CONJUGATES Pharma Mar, S.A. (ES) 2023-03-01 EP disclosed
WO-2021214126-A1 DRUG ANTIBODY CONJUGATES PHARMA MAR, S.A. (ES) 2021-10-28 WO disclosed
EP-3615544-A1 ANTITUMORAL COMPOUNDS Pharma Mar S.A. (ES) 2020-03-04 EP disclosed
WO-2018197663-A1 ANTITUMORAL COMPOUNDS PHARMA MAR, S.A. (ES) 2018-11-01 WO disclosed
WO-2018167270-A1 ANTICANCER COMPOUNDS PHARMA MAR, S.A. (ES) 2018-09-20 WO disclosed
EP-2825542-A1 LIVER X RECEPTOR MODULATORS Vitae Pharmaceuticals, Inc. (US) 2015-01-21 EP disclosed
WO-2013138568-A1 LIVER X RECEPTION MODULATORS VITAE PHARMACEUTICALS, INC. (US) 2013-09-19 WO disclosed
EP-2323994-A1 SYNTHESIS OF INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 Boehringer Ingelheim International GmbH (DE) 2011-05-25 EP disclosed
WO-2010149688-A2 ANTITUMORAL COMPOUNDS PHARMA MAR, S.A. (ES) 2010-12-29 WO disclosed
EP-2231695-A1 ANTITUMORAL COMPOUNDS Pharma Mar S.A. (ES) 2010-09-29 EP disclosed
EP-2231590-A1 ANTITUMORAL COMPOUNDS Pharma Mar S.A. (ES) 2010-09-29 EP disclosed
EP-2158254-A1 POLY(ORGANOPHOSPHAZENE) HYDROGELS FOR DRUG DELIVERY, PREPARATION METHOD THEREOF AND USE THEREOF Korea Institute of Science and Technology (KR) 2010-03-03 EP disclosed
EP-2155806-A1 PHOSPHAZENE HYDROGELS WITH CHEMICAL CORSS -LINK, PREPARATION METHOD THEREOF AND USE THEREOF Korea Institute of Science and Technology (KR) 2010-02-24 EP disclosed
WO-2010010150-A1 SYNTHESIS OF INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-01-28 WO disclosed
WO-2009080769-A1 ANTITUMORAL COMPOUNDS PHARMA MAR, S.A. (ES) 2009-07-02 WO disclosed
WO-2009077401-A1 ANTITUMORAL COMPOUNDS PHARMA MAR, S.A. (ES) 2009-06-25 WO disclosed
WO-2008153277-A1 POLY(ORGANOPHOSPHAZENE) HYDROGELS FOR DRUG DELIVERY, PREPARATION METHOD THEREOF AND USE THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-12-18 WO disclosed
WO-2008153278-A1 PHOSPHAZENE HYDROGELS WITH CHEMICAL CORSS -LINK, PREPARATION METHOD THEREOF AND USE THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-12-18 WO disclosed