SCHEMBL25315864

SCHEMBL25315864

O=C(O)N1CC(F)(F)CC1c1cccc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.45
NTRK1 P04629 2/20 0.43
JAK2 O60674 1/20 0.43
PDE5A O76074 1/20 0.40
OPRK1 P41145 1/20 0.39
MAOB P27338 3/20 0.39
MAOA P21397 2/20 0.39
ROCK2 O75116 2/20 0.38
ALDH1A1 P00352 2/20 0.37
CCR2 P41597 1/20 0.37
GRIN2B Q13224 1/20 0.37
KDM4E B2RXH2 1/20 0.37
PKM P14618 1/20 0.37
NPC1 O15118 1/20 0.36
KDM1A O60341 1/20 0.36
RCOR1 Q9UKL0 1/20 0.36
NR3C2 P08235 1/20 0.36

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
SCHEMBL430829 0.81 RIPK1 (0.50) RIPK1NTRK1JAK2PDE5AOPRK1
SCHEMBL451781 0.81 RIPK1 (0.50) RIPK1NTRK1JAK2PDE5AOPRK1
SCHEMBL21723215 0.81 RIPK1 (0.50) RIPK1NTRK1JAK2PDE5AOPRK1
SCHEMBL29744544 0.81 RIPK1 (0.50) RIPK1NTRK1JAK2PDE5AOPRK1
SCHEMBL18555578 0.80 NTRK1 (0.43) RIPK1NTRK1JAK2
SCHEMBL18555577 0.80 NTRK1 (0.43) RIPK1NTRK1JAK2
SCHEMBL12478217 0.78 NTRK1 (0.40) RIPK1NTRK1JAK2OPRK1MAOB
SCHEMBL4289056 0.77 MAOB (0.45) RIPK1NTRK1JAK2OPRK1MAOB
SCHEMBL30898796 0.74 NTRK1 (0.47) RIPK1NTRK1JAK2PDE5AMAOB
SCHEMBL23632045 0.74 NTRK1 (0.47) RIPK1NTRK1JAK2PDE5AMAOB

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-20230234955-A1 METHOD OF TREATMENT USING SUBSTITUTED PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS ARRAY BIOPHARMA INC (US) 2023-07-27 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-20230234955-A1 METHOD OF TREATMENT USING SUBSTITUTED PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS TYMP, TYMS, TK1 RIPK1 3419/4885NTRK1 1703/4885JAK2 1795/4885

“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.