SCHEMBL167016

SCHEMBL167016

COc1cccc(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.58
MAPT P10636 3/20 0.58
NPSR1 Q6W5P4 2/20 0.58
KDM4E B2RXH2 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
NPC1 O15118 1/20 0.51
HPGD P15428 1/20 0.51
RAB9A P51151 1/20 0.51
ACHE P22303 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
HTT P42858 1/20 0.49
GPR55 Q9Y2T6 1/20 0.49
ALDH1A1 P00352 2/20 0.49
AKR1C3 P42330 1/20 0.49
AKR1C2 P52895 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL29782607 1.00 L3MBTL1 (0.58) L3MBTL1MAPTNPSR1KDM4ESMN1; SMN2
SCHEMBL27295380 0.98 MAPT (0.57) L3MBTL1MAPTNPSR1KDM4ESMN1; SMN2
SCHEMBL4053707 0.92 MAPT (0.53) L3MBTL1MAPTNPSR1KDM4ESMN1; SMN2
SCHEMBL13791556 0.92 L3MBTL1 (0.65) L3MBTL1MAPTNPSR1KDM4ESMN1; SMN2
SCHEMBL27285607 0.89 MAPT (0.50) L3MBTL1MAPTNPSR1KDM4ESMN1; SMN2
SCHEMBL16068235 0.88 NPSR1 (0.57) L3MBTL1MAPTNPSR1KDM4ESMN1; SMN2
SCHEMBL14919359 0.85 ACHE (0.48) L3MBTL1MAPTNPSR1KDM4ESMN1; SMN2
SCHEMBL22864104 0.84 AKR1C3 (0.61) L3MBTL1MAPTSMN1; SMN2TDP1MEN1
SCHEMBL11659217 0.84 MEN1 (0.53) L3MBTL1MAPTNPSR1KDM4ESMN1; SMN2
SCHEMBL14191200 0.83 ACHE (0.47) L3MBTL1MAPTNPSR1KDM4ESMN1; SMN2

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 1311 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1891180-B1 ORGANIC SEMICONDUCTOR SOLUTIONS MERCK PATENT GMBH (DE) 2018-08-29 EP claimed
US-9899196-B1 Dopant-assisted direct analysis in real time mass spectrometry JEOL USA, INC. (US) 2018-02-20 US claimed
EP-1716604-B1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2017-07-26 EP claimed
US-20160329510-A1 PHOTOVOLTAIC CELLS MERCK PATENT GMBH (DE) 2016-11-10 US claimed
EP-3087156-A1 PHOTOVOLTAIC CELLS Merck Patent GmbH (DE) 2016-11-02 EP claimed
US-9169209-B2 Compounds and compositions for the inhibition of NAMPT FORMA TM, LLC (US) 2015-10-27 US claimed
EP-1745520-B1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2015-10-21 EP claimed
WO-2015096886-A1 PHOTOVOLTAIC CELLS MERCK PATENT GMBH (DE) 2015-07-02 WO claimed
EP-2834861-A2 HOLE CARRIER LAYER FOR ORGANIC PHOTOVOLTAIC DEVICE Merck Patent GmbH (DE) 2015-02-11 EP claimed
US-8952083-B2 Fluorocopolymer composition and its production process ASAHI GLASS COMPANY, LIMITED (JP) 2015-02-10 US claimed
US-4451483-A 2,3,4-Trinor-m-inter-phenylene-prostaglandin derivatives and compositions and method for inhibiting blood platelet aggregation CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1984-05-29 US claimed
US-4444691-A HYPOTENSIVE, ANTIULCER AMERICAN CYANAMID COMPANY (US) 1984-04-24 US claimed
EP-0099672-A2 Trans-Delta 2-prostaglandin D derivatives, process for their preparation and compositions containing them ONO PHARMACEUTICAL CO., LTD. (JP) 1984-02-01 EP claimed
EP-0097023-A2 Prostaglandin D derivatives, process for their preparation and compositions containing them ONO PHARMACEUTICAL CO., LTD. (JP) 1983-12-28 EP claimed
US-4399147-A Prostaglandin 12 analogues and their pharmaceutical compositions ONO PHARMACEUTICAL CO. LTD. (JP) 1983-08-16 US claimed
EP-0062902-A1 2,3,4-Trinor-m-inter-phenylene-prostaglandin derivatives, their preparation and pharmaceutical compositions CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1982-10-20 EP claimed
US-4351846-A 3-Hydroxy and 3-oxo-prostaglandin analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1982-09-28 US claimed
US-4209639-A 13-Thia-prostaglandins AMERICAN CYANAMID COMPANY (US) 1980-06-24 US claimed
US-4207332-A Prostaglandin I2 analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1980-06-10 US claimed
US-4088779-A HYPOTENSIVE, ANTIFERTILITY CIBA-GEIGY CORPORATION (US) 1978-05-09 US claimed