SCHEMBL4105342

SCHEMBL4105342

Cc1cccc2cc3c(=O)n(-c4ccc(B(O)O)cc4)cc(C(=O)O)c3nc12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.41
LMNA P02545 5/20 0.40
ALDH1A1 P00352 4/20 0.39
HPGD P15428 1/20 0.39
LPAR5 Q9H1C0 1/20 0.36
HTT P42858 2/20 0.34
POLB P06746 1/20 0.34
RECQL P46063 1/20 0.34
MAPT P10636 4/20 0.34
CASP1 P29466 3/20 0.34
CASP7 P55210 3/20 0.34
HSD17B10 Q99714 3/20 0.34
PABPC1 P11940 1/20 0.34
RORC P51449 1/20 0.34
MAPK1 P28482 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
USP2 O75604 1/20 0.33
CMA1 P23946 1/20 0.33

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
SCHEMBL635071 0.89 KDM4E (0.52) KDM4ELMNAALDH1A1HPGDLPAR5
SCHEMBL634259 0.87 KDM4E (0.55) KDM4ELMNAALDH1A1HPGDLPAR5
SCHEMBL634188 0.83 RAD52 (0.43) KDM4EALDH1A1HTTPOLBMAPT
SCHEMBL634242 0.82 LPAR5 (0.49) KDM4EALDH1A1HPGDLPAR5USP2
SCHEMBL636006 0.81 KDM4E (0.37) KDM4ELMNAALDH1A1HPGDLPAR5
SCHEMBL634087 0.79 KDM4E (0.41) KDM4ELMNAALDH1A1HPGDHTT
SCHEMBL30122318 0.79 KDM4E (0.41) KDM4ELMNAALDH1A1HPGDHTT
SCHEMBL635320 0.76 KMT2A (0.44) KDM4ELMNAALDH1A1HPGDHTT
SCHEMBL4103482 0.75 KDM4E (0.41) KDM4ELMNAALDH1A1HPGDHTT
SCHEMBL634012 0.74 KDM4E (0.40) KDM4ELMNAALDH1A1HPGDHTT

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-20090156630-A1 ANTI-TUMOUR POLYCYCLIC CARBOXAMIDES BAGULEY BRUCE CHARLES 2009-06-18 US claimed

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-20090156630-A1 ANTI-TUMOUR POLYCYCLIC CARBOXAMIDES MKI67, MCL1, CCNI KDM4E 744/4885LMNA 609/4885ALDH1A1 657/4885

“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.