SCHEMBL25939449

SCHEMBL25939449

Cc1ccccc1-c1ccc(-c2cc(C(=O)O)c3ncn(C)c3c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.50
DHODH Q02127 14/20 0.45
PTPN1 P18031 1/20 0.39
KDM5A P29375 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
DPP4 P27487 1/20 0.38
FTO Q9C0B1 1/20 0.38
NR1H4 Q96RI1 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
SCHEMBL25939453 0.89 PIK3R2 (0.41) MCL1DHODHDPP4
SCHEMBL25939447 0.89 DHODH (0.49) MCL1DHODHPTPN1DPP4
SCHEMBL25939422 0.81 MCL1 (0.50) MCL1DHODHPTPN1KDM5AKDM4C
SCHEMBL15973382 0.81 MCL1 (0.50) MCL1DHODHPTPN1FTONR1H4
SCHEMBL25939461 0.80 DHODH (0.58) DHODH
SCHEMBL15973841 0.80 MCL1 (0.51) MCL1DHODHPTPN1KDM5AKDM4C
SCHEMBL23645620 0.74 MCL1 (0.63) MCL1DHODHPTPN1FTONR1H4
SCHEMBL12362542 0.73 DPP4 (0.46) DPP4
SCHEMBL25939425 0.73 DPP4 (0.49) MCL1DPP4
SCHEMBL21905208 0.72 DHODH (0.81) DHODH

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-11717512-B2 Methods of use for trisubstituted benzotriazole derivatives SERVIER PHARMACEUTICALS LLC (US) 2023-08-08 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-11717512-B2 Methods of use for trisubstituted benzotriazole derivatives BRDT, BRPF3, BRD4 MCL1 52/4885DHODH 441/4885PTPN1 3734/4885

“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.