SCHEMBL7576912

SCHEMBL7576912

N#Cc1ccc(C=O)cc1-c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.47
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
PIM1 P11309 2/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KIF11 P52732 2/20 0.40

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
SCHEMBL7577096 0.89 SLC22A12 (0.37) MCL1CA1CA2PIM1KDM4E
SCHEMBL7571117 0.83 CYP11B1 (0.54)
SCHEMBL6988969 0.82 CA1 (0.40) MCL1CA1CA2KDM4EALDH1A1
SCHEMBL7577524 0.80 SLC22A12 (0.41) MCL1CA1CA2KDM4EALDH1A1
SCHEMBL2353695 0.79 CA1 (0.53) MCL1CA1CA2PIM1KDM4E
SCHEMBL7577589 0.79 KDM4E (0.43) MCL1PIM1KDM4EALDH1A1
SCHEMBL7570617 0.79 AR (0.44) KDM4EALDH1A1
SCHEMBL6988176 0.78 PGGT1B (0.42) KDM4E
SCHEMBL28203557 0.77 CA1 (0.60) MCL1CA1CA2PIM1KDM4E
SCHEMBL15856480 0.77 MCL1 (0.47) MCL1CA1CA2PIM1

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-20020019527-A1 Substituted phenyl farnesyltransferase inhibitors ABBOTT LABORATORIES 2002-02-14 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-20020019527-A1 Substituted phenyl farnesyltransferase inhibitors FNTA, FNTB, SLC10A1 MCL1 1726/4885CA1 2251/4885CA2 2981/4885

“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.