SCHEMBL25939422

SCHEMBL25939422

Cc1ccccc1-c1ccc(-c2cc(C(=O)O)c3c(c2)ncn3C)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.50
DPP4 P27487 4/20 0.42
DPP8 Q6V1X1 3/20 0.42
KDM5A P29375 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
DHODH Q02127 10/20 0.40
PTPN1 P18031 1/20 0.39
FTO Q9C0B1 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
EIF4E P06730 1/20 0.37

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
SCHEMBL25939425 0.89 DPP4 (0.49) MCL1DPP4DPP8
SCHEMBL25939429 0.89 DHODH (0.46) MCL1DPP4DPP8DHODHPTPN1
SCHEMBL25939500 0.84 DPP4 (0.47) MCL1DPP4DPP8DHODHPTPN1
SCHEMBL29717631 0.81 MCL1 (0.50) MCL1KDM5AKDM4CKDM5BDHODH
SCHEMBL25939449 0.81 MCL1 (0.50) MCL1DPP4KDM5AKDM4CKDM5B
SCHEMBL15973746 0.81 MCL1 (0.50) MCL1KDM5AKDM4CKDM5BDHODH
SCHEMBL25939516 0.80 DHODH (0.58) DPP4DHODH
SCHEMBL25939456 0.80 DHODH (0.52) DHODH
SCHEMBL25939538 0.78 DPP4 (0.42) MCL1DPP4DPP8KDM4CDHODH
SCHEMBL15973841 0.77 MCL1 (0.51) MCL1KDM5AKDM4CKDM5BDHODH

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-20230285365-A1 USE OF A DHODH INHIBITOR COMPOUND IN COMBINATION CANCER THERAPY SERVIER PHARMACEUTICALS LLC (US) 2023-09-14 US disclosed
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 (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-11717512-B2 Methods of use for trisubstituted benzotriazole derivatives BRDT, BRPF3, BRD4 MCL1 52/4885DPP4 2193/4885DPP8 2932/4885
US-20230285365-A1 USE OF A DHODH INHIBITOR COMPOUND IN COMBINATION CANCER THERAPY DHODH, DHRS9, DLD MCL1 28/4885DPP4 1623/4885DPP8 1968/4885

“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.