Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL9928835

COc1c(C(C)Nc2ncnc3[nH]cnc23)cc(Cl)c(F)c1C1CN(C(C)C)C1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 0.42
FLT1 P17948 2/20 0.32
EPHA2 P29317 2/20 0.32
KDR P35968 2/20 0.32
EPHB4 P54760 1/20 0.32
KCNH2 Q12809 1/20 0.32
WHR1 P49842 1/20 0.32
EHMT2 Q96KQ7 1/20 0.32
EGFR P00533 1/20 0.30
SOS1 Q07889 2/20 0.30

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
Trifluoroacetic Acid SCHEMBL9929544 0.93 PIK3CD (0.42) PIK3CDFLT1EPHA2KDREPHB4
SCHEMBL9929414 0.93 PIK3CD (0.45) PIK3CDFLT1EPHA2KDREPHB4
Trifluoroacetic Acid SCHEMBL9929146 0.93 PIK3CD (0.51) PIK3CDWHR1EHMT2
Trifluoroacetic Acid SCHEMBL9928972 0.87 PIK3CD (0.41) PIK3CD
Trifluoroacetic Acid SCHEMBL9929171 0.86 PIK3CD (0.52) PIK3CD
Trifluoroacetic Acid SCHEMBL9929571 0.86 PIK3CD (0.40) PIK3CDEGFR
Trifluoroacetic Acid SCHEMBL9929170 0.85 PIK3CD (0.41) PIK3CDEGFRSOS1
Trifluoroacetic Acid SCHEMBL9929085 0.85 PIK3CD (0.42) PIK3CDSOS1
SCHEMBL9928936 0.85 PIK3CD (0.46) PIK3CDFLT1EPHA2KDREPHB4
Trifluoroacetic Acid SCHEMBL9928702 0.84 PIK3CD (0.52) PIK3CDSOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3660016-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS Incyte Holdings Corporation (US) 2020-06-03 EP disclosed
EP-2655374-B1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE HOLDINGS CORP (US) 2019-10-23 EP disclosed
US-9815839-B2 N-(1-(substituted-phenyl)ethyl)-9H-purin-6-amines as PI3K inhibitors INCYTE CORPORATION (US) 2017-11-14 US disclosed
US-20170158696-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE CORPORATION 2017-06-08 US disclosed
US-9527848-B2 N-(1-(substituted-phenyl)ethyl)-9H-purin-6-amines as PI3K inhibitors INCYTE HOLDINGS CORPORATION (US) 2016-12-27 US disclosed
US-20150284390-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2015-10-08 US disclosed
US-9096600-B2 N-(1-(substituted-phenyl)ethyl)-9H-purin-6-amines as PI3K inhibitors INCYTE CORPORATION (US) 2015-08-04 US disclosed
US-20120157430-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE CORPORATION 2012-06-21 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-20120157430-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PI4KB PIK3CD 2/4885FLT1 1256/4885EPHA2 852/4885
US-20150284390-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PI4KB PIK3CD 2/4885FLT1 1256/4885EPHA2 852/4885
US-20170158696-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PI4KB PIK3CD 2/4885FLT1 1256/4885EPHA2 852/4885

“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.