SCHEMBL7967901

SCHEMBL7967901

O=C(c1ccc(F)c(F)c1)c1ccc(F)c(F)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.73
CES1 P23141 2/20 0.73
HSD17B14 Q9BPX1 1/20 0.50
VNN1 O95497 4/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
CHRNA1 P02708 1/20 0.47
CHRNG P07510 1/20 0.47
CHRNB1 P11230 1/20 0.47
CHRNB2 P17787 1/20 0.47
SLC6A2 P23975 1/20 0.47
CHRNB4 P30926 1/20 0.47
CHRNA3 P32297 1/20 0.47
CHRNA4 P43681 1/20 0.47
SLC6A3 Q01959 1/20 0.47
CHRND Q07001 1/20 0.47
IGFBP3 P17936 1/20 0.46
PLA2G7 Q13093 1/20 0.46
KCNQ3 O43525 2/20 0.44
KCNQ2 O43526 2/20 0.44

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
SCHEMBL332679 0.89 ATM (0.61) CES2CES1HSD17B14VNN1KMT2A
SCHEMBL13991056 0.87 CES2 (0.57) CES2CES1HSD17B14VNN1KMT2A
SCHEMBL8845773 0.87 ALDH1A1 (0.64) CES2CES1KMT2AMEN1SLC6A2
SCHEMBL5684908 0.85 CES2 (0.55) CES2CES1HSD17B14VNN1KMT2A
SCHEMBL29798141 0.84 CES1 (1.00) CES2CES1KMT2AMEN1CHRNA1
SCHEMBL1002846 0.84 CES2 (0.53) CES2CES1HSD17B14VNN1KMT2A
SCHEMBL13664921 0.84 CES2 (0.53) CES2CES1HSD17B14VNN1KMT2A
Hydrochloric Acid SCHEMBL10459098 0.84 LTA4H (0.63) CES2CES1VNN1KMT2AMEN1
SCHEMBL7802223 0.82 CES2 (0.52) CES2CES1HSD17B14VNN1KMT2A
SCHEMBL6113460 0.82 HPGD (0.62) CES2CES1VNN1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63188643-A None JP disclosed
CN-109400610-A Pyrrolo-triazine analog derivative, preparation method and its purposes in medicine 浙江海正药业股份有限公司 2019-03-01 CN disclosed
CN-104940202-B Inhibitors of influenza viruses replication 沃泰克斯药物股份有限公司 2018-10-16 CN disclosed
CN-107278205-A Substituted nucleoside derivates as anticarcinogen 辉瑞大药厂 2017-10-20 CN disclosed
US-9522364-B2 Treated mixed matrix polymeric membranes SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2016-12-20 US disclosed
US-9522364-B2 Treated mixed matrix polymeric membranes SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2016-12-20 US disclosed
US-9492785-B2 UV and thermally treated polymeric membranes SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2016-11-15 US disclosed
US-9492785-B2 UV and thermally treated polymeric membranes SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2016-11-15 US disclosed
US-20160263533-A1 TREATED MIXED MATRIX POLYMERIC MEMBRANES SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2016-09-15 US disclosed
US-20160263531-A1 PLASMA-TREATED POLYMERIC MEMBRANES SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2016-09-15 US disclosed
US-7758751-B1 UV-cross-linked membranes from polymers of intrinsic microporosity for liquid separations UOP LLC (US) 2010-07-20 US disclosed
US-7690514-B2 Microporous polymer material THE UNIVERSITY OF MANCHESTER (GB) 2010-04-06 US disclosed
US-7690514-B2 Microporous polymer material THE UNIVERSITY OF MANCHESTER (GB) 2010-04-06 US disclosed
US-6274583-B1 Alpha 1a adrenergic receptor antagonists MERCK & CO., INC. 2001-08-14 US disclosed
US-5977115-A Alpha 1a adrenergic receptor antagonists MERCK & CO., INC. (US) 1999-11-02 US disclosed
EP-0833637-A4 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONIST MERCK & CO INC (US) 1998-07-08 EP disclosed
EP-0833637-A1 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONIST Merck & Co., Inc. (US) 1998-04-08 EP disclosed
WO-1996040136-A1 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONIST MERCK & CO., INC. (US) 1996-12-19 WO disclosed
US-4876382-A Process for making fluorobenzoic acid fluorophenylesters CENTRAL GLASS COMPANY, LIMITED (JP) 1989-10-24 US disclosed
JP-S63188643-A NOVEL FLUORINE-CONTAINING BENZOPHENONE AND PRODUCTION THEREOF CENTRAL GLASS CO LTD 1988-08-04 JP disclosed