Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6458355

Cc1cc(N[C@H]2CC[C@@H](NC(=O)Nc3cccc(Cl)c3)CC2)nc2ccccc12.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.49
EPHX2 P34913 2/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
EPHX1 P07099 1/20 0.49
TSHR P16473 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPT P10636 6/20 0.49
GAA P10253 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GPR6 P46095 2/20 0.44
TP53 P04637 3/20 0.44
MCHR1 Q99705 2/20 0.43
ADRA2A P08913 1/20 0.43
PAK1 Q13153 1/20 0.42
UBE2M P61081 1/20 0.42
DCUN1D1 Q96GG9 1/20 0.42

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 SCHEMBL6461174 0.90 SMN1; SMN2 (0.49) LMNAEPHX2MEN1NPC1TSHR
Trifluoroacetic Acid SCHEMBL6457766 0.88 NPC1 (0.52) LMNAMEN1NPC1RAB9AKMT2A
Trifluoroacetic Acid SCHEMBL6457569 0.86 KDM4E (0.52) LMNAEPHX1KDM4ESMN1; SMN2GPR6
Trifluoroacetic Acid SCHEMBL6467228 0.86 LMNA (0.51) LMNAEPHX2MEN1KMT2AKDM4E
SCHEMBL6874008 0.82 SMN1; SMN2 (0.53) LMNAEPHX2MEN1NPC1EPHX1
SCHEMBL6874005 0.82 SMN1; SMN2 (0.53) LMNAEPHX2MEN1NPC1EPHX1
SCHEMBL6456788 0.80 MCHR1 (0.66) LMNANPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL6456795 0.80 MCHR1 (0.66) LMNANPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL6462137 0.79 SMN1; SMN2 (0.54) LMNAEPHX2MEN1NPC1EPHX1
SCHEMBL6462132 0.79 SMN1; SMN2 (0.54) LMNAEPHX2MEN1NPC1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO., LTD. 2005-09-08 US disclosed
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 EP 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 (1 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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof HCRTR2, MCHR1, MCHR2 LMNA 3391/4885EPHX2 1053/4885MEN1 734/4885

“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.