SCHEMBL3930157

SCHEMBL3930157

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1-c1ccc2ncsc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 8/20 0.67
KDR P35968 7/20 0.67
MAPK14 Q16539 7/20 0.67
JAK3 P52333 6/20 0.67
TEK Q02763 4/20 0.67
BRAF P15056 4/20 0.66
DDR2 Q16832 5/20 0.61
KMT2A Q03164 4/20 0.59
MEN1 O00255 3/20 0.59
NPC1 O15118 3/20 0.59
RAB9A P51151 3/20 0.59
POLB P06746 1/20 0.59
RAF1 P04049 3/20 0.57
KIT P10721 2/20 0.55
ABL1 P00519 1/20 0.55
BCR P11274 1/20 0.55
DDR1 Q08345 1/20 0.55
SRC P12931 1/20 0.54
TYK2 P29597 1/20 0.54
SYK P43405 1/20 0.54

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
SCHEMBL3937680 0.93 KDR (0.67) LCKKDRMAPK14JAK3TEK
SCHEMBL4017741 0.93 LCK (0.66) LCKKDRMAPK14JAK3TEK
SCHEMBL3937358 0.85 KDR (0.66) LCKKDRMAPK14JAK3TEK
SCHEMBL14042145 0.82 BRAF (0.73) LCKKDRMAPK14BRAFKMT2A
SCHEMBL3932005 0.81 LCK (0.76) LCKKDRMAPK14JAK3TEK
SCHEMBL5494397 0.80 LCK (0.70) LCKKDRMAPK14JAK3TEK
SCHEMBL5493878 0.80 LCK (0.81) LCKKDRMAPK14JAK3TEK
Hydrochloric Acid SCHEMBL5488772 0.80 LCK (0.75) LCKKDRMAPK14JAK3TEK
SCHEMBL31620873 0.80 LCK (1.00) LCKKDRMAPK14JAK3TEK
SCHEMBL5496737 0.80 LCK (1.00) LCKKDRMAPK14JAK3TEK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090306083-A1 Use of Trifluoromethyl Substituted Benzamides in teh Treatment of Neurological Disorders NOVARTIS AG 2009-12-10 US claimed
EP-2043638-A2 USE OF TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES IN THE TREATMENT OF NEUROLOGICAL DISORDERS Novartis AG (CH) 2009-04-08 EP claimed
US-20080096883-A1 Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG (CH) 2008-04-24 US claimed
WO-2008008821-A2 USE OF TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES IN THE TREATMENT OF NEUROLOGICAL DISORDERS NOVARTIS AG (CH) 2008-01-17 WO claimed
EP-1778640-A1 TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES AS KINASE INHIBITORS Novartis AG (CH) 2007-05-02 EP claimed
WO-2006015859-A1 TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2006-02-16 WO claimed
US-20060035897-A1 Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG (CH) 2006-02-16 US claimed
US-20090306083-A1 Use of Trifluoromethyl Substituted Benzamides in teh Treatment of Neurological Disorders NOVARTIS AG 2009-12-10 US disclosed
US-20090306083-A1 Use of Trifluoromethyl Substituted Benzamides in teh Treatment of Neurological Disorders NOVARTIS AG 2009-12-10 US disclosed
US-20090306083-A1 Use of Trifluoromethyl Substituted Benzamides in teh Treatment of Neurological Disorders NOVARTIS AG 2009-12-10 US disclosed
EP-2043638-A2 USE OF TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES IN THE TREATMENT OF NEUROLOGICAL DISORDERS Novartis AG (CH) 2009-04-08 EP disclosed
US-20080096883-A1 Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG (CH) 2008-04-24 US disclosed
US-20080096883-A1 Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG (CH) 2008-04-24 US disclosed
US-20080096883-A1 Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG (CH) 2008-04-24 US disclosed
WO-2008008821-A2 USE OF TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES IN THE TREATMENT OF NEUROLOGICAL DISORDERS NOVARTIS AG (CH) 2008-01-17 WO disclosed
WO-2008008821-A2 USE OF TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES IN THE TREATMENT OF NEUROLOGICAL DISORDERS NOVARTIS AG (CH) 2008-01-17 WO disclosed
EP-1778640-A1 TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES AS KINASE INHIBITORS Novartis AG (CH) 2007-05-02 EP disclosed
WO-2006015859-A1 TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2006-02-16 WO disclosed
US-20060035897-A1 Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG (CH) 2006-02-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080096883-A1 Trifluoromethyl substituted benzamides as kinase inhibitors MAP3K1, MAP3K20, MAP3K2 LCK 77/4885KDR 872/4885MAPK14 43/4885
US-20090306083-A1 Use of Trifluoromethyl Substituted Benzamides in teh Treatment of Neurological Disorders EPHB3, EPHB2, EPHB1 LCK 433/4885KDR 1129/4885MAPK14 2431/4885
US-20060035897-A1 Trifluoromethyl substituted benzamides as kinase inhibitors ABL1, ERBB2, EPHB2 LCK 59/4885KDR 105/4885MAPK14 88/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.