SCHEMBL21749166

SCHEMBL21749166

Cc1nc2cc(-c3ccc(C(F)(F)F)cc3Cl)nn2c(Cl)c1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.39
DPP8 Q6V1X1 4/20 0.39
DPP9 Q86TI2 3/20 0.39
CYP1A2 P05177 2/20 0.39
TP53 P04637 3/20 0.37
CYP3A4 P08684 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
PDE2A O00408 1/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL21749170 0.90 HSD11B1 (0.40) DPP4DPP8DPP9CYP1A2TP53
SCHEMBL21749188 0.89 DPP4 (0.38) DPP4DPP8DPP9CYP1A2TP53
SCHEMBL20502590 0.86 NPC1 (0.46) TP53CYP2C19ALDH1A1SMN1; SMN2NPC1
SCHEMBL20503113 0.77 MPL (0.39) CYP1A2TP53CYP3A4CYP2C9CYP2C19
SCHEMBL21749147 0.76 BTK (0.36) DPP4TP53
SCHEMBL21775434 0.76 DPP4 (0.38) DPP4DPP8DPP9CYP1A2TP53
SCHEMBL21749175 0.75 CYP11B2 (0.46) TP53CYP2C19PDE2AALDH1A1SMN1; SMN2
SCHEMBL21749152 0.74 NPC1 (0.59) DPP4DPP8DPP9TP53CYP3A4
SCHEMBL21775853 0.74 DPP4 (0.51) DPP4DPP8DPP9CYP3A4CYP2C9
SCHEMBL20502816 0.72 NPC1 (0.46) TP53CYP2C19ALDH1A1SMN1; SMN2NPC1

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-10960007-B2 Pharmacologically active aryl-substituted pyrazolo[1,5-a]pyrimidine derivatives RICHTER GEDEON NYRT. (HU) 2021-03-30 US disclosed
US-20200061068-A1 Pharmacologically Active Aryl-Substituted Pyrazolo[1,5-a]Pyrimidine Derivatives RICHTER GEDEON NYRT. (HU) 2020-02-27 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 (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-20200061068-A1 Pharmacologically Active Aryl-Substituted Pyrazolo[1,5-a]Pyrimidine Derivatives GABRA5, P2RX5, P2RY1 DPP4 721/4885DPP8 1147/4885DPP9 850/4885
US-10960007-B2 Pharmacologically active aryl-substituted pyrazolo[1,5-a]pyrimidine derivatives GABRA5, P2RX5, P2RY1 DPP4 721/4885DPP8 1147/4885DPP9 850/4885

“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.