Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4886766

CN1CCCN(C(=O)c2ccc(Nc3cncc(-c4cc5cnccc5[nH]4)n3)nc2)CC1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 3/20 0.47
CDK9 P50750 3/20 0.47
HRH4 Q9H3N8 2/20 0.46
CDK6 Q00534 2/20 0.41
RIPK1 Q13546 1/20 0.41
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40
CDK2 P24941 1/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NAMPT P43490 3/20 0.40
CYP2C9 P11712 1/20 0.40
TYK2 P29597 1/20 0.39
GRM5 P41594 2/20 0.39
HRH3 Q9Y5N1 1/20 0.38
SYK P43405 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL2932620 0.95 HRH4 (0.51) CCNT1CDK9HRH4CDK6RIPK1
SCHEMBL2933133 0.86 HRH4 (0.52) CCNT1CDK9HRH4CDK6RIPK1
SCHEMBL2931520 0.76 HRH4 (0.55) CCNT1CDK9HRH4CDK6RIPK1
Trifluoroacetic Acid SCHEMBL2933461 0.76 DYRK1A (0.48)
Trifluoroacetic Acid SCHEMBL2928635 0.74 DYRK1A (0.47) HRH4
Trifluoroacetic Acid SCHEMBL4891059 0.74 HRH4 (0.46) CCNT1CDK9HRH4RIPK1CDK2
SCHEMBL2927798 0.74 HRH4 (0.51) CCNT1CDK9HRH4CDK6CDK4
SCHEMBL2933155 0.73 GRM5 (0.58) CCNT1CDK9CDK6HPGDPOLB
SCHEMBL2927025 0.73 KDR (0.47) HRH4CDK2TYK2
SCHEMBL2928618 0.72 KDM4E (0.52) CCNT1CDK9RIPK1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 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 (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-20080039450-A1 Compounds NEK2, CSNK2A3, CSNK2A1 CCNT1 747/4885CDK9 319/4885HRH4 1833/4885

“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.