SCHEMBL6835634

SCHEMBL6835634

COCCOCCCSc1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)O)cn1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALB P02768 1/20 0.77
KDM4E B2RXH2 2/20 0.48
SERPINE1 P05121 8/20 0.47
HTT P42858 1/20 0.46
TP53 P04637 1/20 0.45
KCNK2 O95069 1/20 0.44
KCNK10 P57789 1/20 0.44
PLK1 P53350 2/20 0.43
AKR1C4 P17516 1/20 0.43
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43
AKR1C1 Q04828 1/20 0.43
F10 P00742 1/20 0.43
CXCR1 P25024 1/20 0.43
CXCR2 P25025 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42

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
SCHEMBL6833894 0.89 ALB (0.77) ALBKDM4EHTTKCNK2KCNK10
SCHEMBL6821338 0.88 ALB (0.60) ALBKDM4ESERPINE1KCNK2KCNK10
SCHEMBL6830537 0.87 ALB (1.00) ALBKDM4EHTTPLK1AKR1C2
SCHEMBL6835722 0.85 PLK1 (0.57) ALBKDM4ESERPINE1HTTTP53
SCHEMBL6818627 0.78 ALB (0.59) ALBKDM4EKCNK2KCNK10PLK1
SCHEMBL6819161 0.76 ALB (0.79) ALBPLK1AKR1C2AKR1C1F10
SCHEMBL6834113 0.74 KDM4E (0.46) ALBKDM4ESERPINE1KCNK2KCNK10
SCHEMBL6813815 0.74 PLK1 (0.57) ALBKDM4EHTTKCNK2KCNK10
SCHEMBL6818760 0.73 PLK1 (0.49) ALBKDM4ESERPINE1KCNK2KCNK10
SCHEMBL6830644 0.73 ALB (0.77) ALBKDM4EHTTPLK1AKR1C2

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-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 ALB 1417/4885KDM4E 1240/4885SERPINE1 1860/4885

“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.