SCHEMBL1237189

SCHEMBL1237189

O=C(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.79

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.79
CES2 O00748 2/20 0.77
CNR1 P21554 1/20 0.62
CNR2 P34972 3/20 0.59
LMNA P02545 2/20 0.59
NPSR1 Q6W5P4 1/20 0.59
P2RX1 P51575 1/20 0.59
MAPT P10636 2/20 0.58
MEN1 O00255 2/20 0.58
ALDH1A1 P00352 2/20 0.58
KMT2A Q03164 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
ADORA1 P30542 1/20 0.58
HSD17B10 Q99714 1/20 0.58
POLB P06746 1/20 0.57
HPGD P15428 1/20 0.57
VNN1 O95497 2/20 0.56
MAOB P27338 1/20 0.56

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
SCHEMBL1044812 0.94 SRD5A2 (0.83) SRD5A2CES2CNR1CNR2LMNA
SCHEMBL2941622 0.92 SRD5A2 (0.81) SRD5A2CES2CNR1CNR2LMNA
SCHEMBL17586586 0.89 KCNK3 (0.67) SRD5A2CES2CNR1CNR2NPSR1
SCHEMBL7486845 0.89 SRD5A2 (0.76) SRD5A2CES2CNR1CNR2LMNA
SCHEMBL28565479 0.88 SRD5A2 (0.73) SRD5A2CES2CNR1CNR2MEN1
SCHEMBL4979512 0.88 SRD5A2 (0.73) SRD5A2CES2CNR1CNR2LMNA
SCHEMBL5687867 0.88 SRD5A2 (0.69) SRD5A2CES2CNR1CNR2LMNA
SCHEMBL17894214 0.88 SRD5A2 (0.73) SRD5A2CES2CNR1CNR2LMNA
SCHEMBL27770546 0.88 SRD5A2 (0.73) SRD5A2CES2CNR1CNR2LMNA
SCHEMBL3176325 0.87 CES2 (1.00) SRD5A2CES2LMNANPSR1P2RX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107108630-B Substituted N- (pyrrolidin-3-yl) -7H-pyrrolo [2,3-D ] pyrimidin-4-amines as JANUS kinase inhibitors 阳智化学(株) 2019-10-15 CN claimed
CN-110003200-A P2X7 regulator 詹森药业有限公司 2019-07-12 CN claimed
CN-105209464-B P2X7 modulators 詹森药业有限公司 2019-01-01 CN claimed
CN-108864075-A A kind of isothiazole connection thiazole and its preparation method and application 南开大学 2018-11-23 CN claimed
CN-104093709-B It is used as the imidazole derivative of aldosterone synthase inhibitors 霍夫曼-拉罗奇有限公司 2017-09-22 CN claimed
CN-107108630-A Substituted N- (pyrrolidin-3-yl) -7H-pyrrolo [2,3-D ] pyrimidin-4-amines as JANUS kinase inhibitors 阳智化学(株) 2017-08-29 CN claimed
CN-104119285-B Compound and application thereof as estrogen-related receptor modulator 中国科学院广州生物医药与健康研究院 2016-06-29 CN claimed
CN-105209464-A P2x7 modulators JANSSEN PHARMACEUTICA NV 2015-12-30 CN claimed
CN-104119285-A Compound used as estrogen-related receptor regulator and application of compound GUANGZHOU INST BIOMED & HEALTH 2014-10-29 CN claimed
EP-0890131-A2 PROCESS AND MATERIALS FOR INDUCING PRE-TILT IN LIQUID CRYSTALS AND LIQUID CRYSTAL DISPLAYS ALLIANT TECHSYSTEMS INC. (US) 1999-01-13 EP claimed
US-5856430-A Process and materials for inducing pre-tilt in liquid crystals and liquid crystal displays ALLIANT TECHSYSTEMS INC. (US) 1999-01-05 US claimed
US-5817743-A ANISOTROPICALLY ABSORBING MOLECULES, POLARIZED LIGHT ALLIANT TECHSYSTEMS INC. (US) 1998-10-06 US claimed
WO-1997037273-A2 PROCESS AND MATERIALS FOR INDUCING PRE-TILT IN LIQUID CRYSTALS AND LIQUID CRYSTAL DISPLAYS ALLIANT TECHSYSTEMS INC. (US) 1997-10-09 WO claimed
US-20250158057-A1 CATHODE HAVING DOPED METAL FLUORIDE CORE-SHELL PARTICLE AND BATTERIES COMPRISING THE SAME U.S. DEPARTMENT OF ENERGY 2025-05-15 US disclosed
US-10558089-B2 Photoalignment composition ROLIC AG (CH) 2020-02-11 US disclosed
CN-107108630-B Substituted N- (pyrrolidin-3-yl) -7H-pyrrolo [2,3-D ] pyrimidin-4-amines as JANUS kinase inhibitors 阳智化学(株) 2019-10-15 CN disclosed
EP-0156278-B1 PROCESS FOR THE PREPARATION OF SYMMETRICAL BENZOPHENONES SUBSTITUTED BY FLUOR-CONTAINING GROUPS, THEIR USE AND SYMMETRICAL BENZOPHENONES SUBSTITUTED BY FLUOR-CONTAINING GROUPS BAYER AG (DE) 1988-03-02 EP disclosed
EP-0156278-A2 Process for the preparation of symmetrical benzophenones substituted by fluor-containing groups, their use and symmetrical benzophenones substituted by fluor-containing groups BAYER AG (DE) 1985-10-02 EP disclosed
US-4175945-A PLANT GROWTH REGULATORS FOR TABACCO ROHM AND HAAS COMPANY (US) 1979-11-27 US disclosed
US-4120687-A CONTROLLING GROWTH OF TOBACCO SUCKERS MEISINGER ROBERT H 1978-10-17 US disclosed