SCHEMBL14669489

SCHEMBL14669489

CCOc1ccc2cc([C@H]3CC(c4ccc(Br)cc4)=NN3C(=O)CCC(=O)O)c(Cl)nc2c1

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.76
▸ BLM P54132 2/20 0.76
▸ MAPT P10636 3/20 0.69
▸ THRB P10828 1/20 0.69
▸ PKM P14618 2/20 0.61
▸ KDM4E B2RXH2 2/20 0.61
▸ P2RY6 Q15077 1/20 0.55
▸ HPGD P15428 1/20 0.54
▸ LMNA P02545 1/20 0.49
▸ RXRA P19793 1/20 0.49
▸ RXRB P28702 1/20 0.49
▸ RXRG P48443 1/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47

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
SCHEMBL12184267 1.00 POLB (0.76) POLBBLMMAPTTHRBPKM
SCHEMBL22420594 0.95 POLB (0.76) POLBBLMMAPTTHRBPKM
SCHEMBL22420543 0.93 POLB (0.88) POLBBLMMAPTTHRBPKM
SCHEMBL17748317 0.92 POLB (0.76) POLBBLMMAPTTHRBPKM
SCHEMBL23519982 0.89 POLB (0.79) POLBBLMMAPTTHRBPKM
SCHEMBL23500087 0.88 POLB (0.73) POLBBLMMAPTTHRBPKM
SCHEMBL29878445 0.88 POLB (0.73) POLBBLMMAPTTHRBPKM
SCHEMBL23499892 0.88 POLB (0.78) POLBBLMMAPTTHRBPKM
SCHEMBL29878640 0.88 POLB (0.78) POLBBLMMAPTTHRBPKM
SCHEMBL23499859 0.87 POLB (0.76) POLBBLMMAPTTHRBPKM

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-20130028989-A1 MATERIALS AND METHOD FOR INHIBITING REPLICATION PROTEIN A AND USES THEREOF INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2013-01-31 — — 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-20130028989-A1 MATERIALS AND METHOD FOR INHIBITING REPLICATION PROTEIN A AND USES THEREOF RPA1, RPA3, PCNA POLB 98/4885BLM 31/4885MAPT 4175/4885

“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.

Send feedback