Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4438472

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1ccc2c(c1)[nH]c1ncncc12.O=C(O)C(F)(F)F

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 7/20 0.62
LCK P06239 5/20 0.58
MAPK14 Q16539 5/20 0.58
KDR P35968 4/20 0.58
JAK3 P52333 3/20 0.58
TEK Q02763 2/20 0.58
BRAF P15056 4/20 0.53
ABL1 P00519 2/20 0.53
KIT P10721 2/20 0.53
SRC P12931 1/20 0.53
FGFR1 P11362 1/20 0.51
RAF1 P04049 4/20 0.50
CSF1R P07333 1/20 0.49
BTK Q06187 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
SCHEMBL2304084 0.97 DDR2 (0.65) DDR2LCKMAPK14KDRJAK3
SCHEMBL2304975 0.90 DDR2 (0.65) DDR2LCKMAPK14KDRJAK3
SCHEMBL2306981 0.90 DDR2 (0.63) DDR2LCKMAPK14KDRJAK3
SCHEMBL2302812 0.89 DDR2 (0.54) DDR2LCKMAPK14KDRJAK3
Trifluoroacetic Acid SCHEMBL4997345 0.89 KDR (0.67) DDR2LCKMAPK14KDRJAK3
SCHEMBL2304040 0.88 DDR2 (0.65) DDR2LCKMAPK14KDRJAK3
SCHEMBL2307402 0.87 DDR2 (0.65) DDR2LCKMAPK14KDRJAK3
SCHEMBL2307590 0.87 RAF1 (0.57) DDR2BRAFRAF1
SCHEMBL2307039 0.87 KDR (0.60) DDR2LCKMAPK14KDRJAK3
SCHEMBL2306992 0.86 DDR2 (0.51) DDR2LCKMAPK14KDRJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8841318-B2 Substituted heterocycles as janus kinase inhibitors INCYTE CORPORATION (US) 2014-09-23 US disclosed
US-20130274257-A1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS INCYTE CORPORATION 2013-10-17 US disclosed
US-8513270-B2 Substituted heterocycles as Janus kinase inhibitors INCYTE CORPORATION (US) 2013-08-20 US disclosed
EP-2121692-B1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS INCYTE CORP (US) 2013-04-10 EP disclosed
EP-2121692-A1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS Incyte Corporation (US) 2009-11-25 EP disclosed
US-20080188500-A1 e.g. N-[4-methyl-3-(9H-pyrimido[4,5-b]indol-7-yl)phenyl]-3-(trifluoromethyl)benzamide; Janus kinases inhibitor; anticarcinogenic agent; immune-related diseases, skin disorders, myeloid proliferative disorders INCYTE CORPORATION 2008-08-07 US disclosed
WO-2008079965-A1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-07-03 WO 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 (2 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-20080188500-A1 e.g. N-[4-methyl-3-(9H-pyrimido[4,5-b]indol-7-yl)phenyl]-3-(trifluoromethyl)benzamide; Janus kinases inhibitor; anticarcinogenic agent; immune-related diseases, skin disorders, myeloid proliferative disorders JAK3, JAK1, JAK2 DDR2 833/4885LCK 50/4885MAPK14 54/4885
US-20130274257-A1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS JAK1, JAK3, JAK2 DDR2 735/4885LCK 34/4885MAPK14 80/4885

“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.