SCHEMBL11293097

SCHEMBL11293097

FC(F)(Cl)c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
MAPK1 P28482 2/20 0.52
HIF1A Q16665 2/20 0.52
LMNA P02545 2/20 0.47
CYP2A6 P11509 1/20 0.47
CYP19A1 P11511 9/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MIF P14174 1/20 0.38
IDO1 P14902 1/20 0.36
AHR P35869 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
SCHEMBL4204801 0.87 PDE2A (0.36) TSHRMAPK1HIF1ACYP19A1AHR
Hydrochloric Acid SCHEMBL8577339 0.84 PDE2A (0.35) TSHRMAPK1HIF1ACYP19A1IDO1
Hydrochloric Acid SCHEMBL8577343 0.84 PDE2A (0.35) TSHRMAPK1HIF1ACYP19A1IDO1
SCHEMBL11458379 0.82 TSHR (0.52) TSHRMAPK1HIF1ALMNACYP2A6
SCHEMBL5401000 0.79 LMNA (0.50) TSHRMAPK1HIF1ALMNACYP2A6
SCHEMBL809832 0.79 LMNA (0.50) TSHRMAPK1HIF1ALMNACYP2A6
SCHEMBL28777340 0.79 CYP19A1 (0.55) TSHRMAPK1HIF1ALMNACYP2A6
SCHEMBL11240836 0.79 PDE2A (0.32) TSHRMAPK1HIF1A
SCHEMBL1508480 0.79 ALDH1A1 (0.50) TSHRAHR
SCHEMBL196588 0.79 CYP19A1 (0.55) TSHRMAPK1HIF1ALMNACYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0004636-B1 PROCESS FOR PREPARING BENZOTRIFLUORIDE AND ITS DERIVATIVES Daikin Kogyo Co., Ltd. (JP) 1982-07-07 EP disclosed
US-4242286-A Process for preparing benzotrifluoride and its derivatives DAIKIN KOGYO CO., LTD. (JP) 1980-12-30 US disclosed
US-4183873-A WITH HYDROGEN FLUORIDE IN THE PRESENCE OF MOLYBDENUM PENTACHLORIDE CATALYST HOOKER CHEMICALS & PLASTICS CORP. (US) 1980-01-15 US disclosed
EP-0004636-A2 Process for preparing benzotrifluoride and its derivatives Daikin Kogyo Co., Ltd. (JP) 1979-10-17 EP disclosed