Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1658285

COc1c(OCCC2CNCCO2)ccc2c1N=C(NC(=O)c1cccnc1)N1CCN=C21.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.32
KCNH2 Q12809 2/20 0.32
SLC6A3 Q01959 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
BRD4 O60885 2/20 0.32

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
SCHEMBL1655931 0.96 CHRNA7 (0.34) CHRNA7KCNH2BRD4
SCHEMBL19910634 0.93 CHRNA7 (0.34) CHRNA7KCNH2BRD4
SCHEMBL1655359 0.90 ADRA2C (0.39) CHRNA7KCNH2SLC6A3
SCHEMBL1658237 0.85 HTT (0.34)
Trifluoroacetic Acid SCHEMBL1655457 0.85 CD274 (0.35)
Trifluoroacetic Acid SCHEMBL29475094 0.85 CD274 (0.35)
SCHEMBL1655364 0.84 DRD4 (0.35)
SCHEMBL1655570 0.84 DRD4 (0.35) KCNH2
SCHEMBL29618257 0.83 EPHA2 (0.34)
SCHEMBL12730124 0.83 EPHA2 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE46856-E1 Substituted 2,3-dihydroimidazo[1,2-c]quinazoline derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis BAYER INTELLECTUAL PROPERTY GMBH (DE) 2018-05-22 US disclosed
EP-2096919-B1 SUBSTITUTED 2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS BAYER IP GMBH (DE) 2016-03-02 EP disclosed
US-20130261113-A1 SUBSTITUTED 2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS BAYER PHARMACEUTICALS CORPORATION 2013-10-03 US disclosed
US-8466283-B2 Substituted 2,3-dihydroimidazo[1,2-c]quinazoline derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-06-18 US disclosed
US-20110083984-A1 Substituted 2,3-dihydroimidazo[1,2-c]quinazoline Derivatives Useful for Treating Hyper-Proliferative Disorders and Diseases Associated with Angiogenesis BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-04-14 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 (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-20130261113-A1 SUBSTITUTED 2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS PIK3CA, PIK3CD, PIK3CB CHRNA7 4528/4885KCNH2 4198/4885SLC6A3 2664/4885
US-20110083984-A1 Substituted 2,3-dihydroimidazo[1,2-c]quinazoline Derivatives Useful for Treating Hyper-Proliferative Disorders and Diseases Associated with Angiogenesis PIK3CA, PIK3CD, PIK3CB CHRNA7 4528/4885KCNH2 4198/4885SLC6A3 2664/4885

“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.