SCHEMBL4565436

SCHEMBL4565436

NOc1ccc2ccccc2c1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.53
KDM4E B2RXH2 3/20 0.53
HSD17B10 Q99714 3/20 0.53
ALDH1A1 P00352 3/20 0.53
GLA P06280 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
WDR5 P61964 1/20 0.46
NCEH1 Q6PIU2 6/20 0.45
METAP2 P50579 2/20 0.45
METAP1 P53582 1/20 0.45
LDHA P00338 1/20 0.44
NR4A1 P22736 1/20 0.44
NR4A2 P43354 1/20 0.44
NR4A3 Q92570 1/20 0.44
CDC25B P30305 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
MAPT P10636 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
SCHEMBL914280 0.84 ALDH1A1 (0.55) HPGDKDM4EHSD17B10ALDH1A1GLA
SCHEMBL3317320 0.84 ALDH1A1 (0.55) HPGDKDM4EHSD17B10ALDH1A1GLA
SCHEMBL979842 0.82 CA12 (0.58) HPGDKDM4EHSD17B10ALDH1A1GLA
SCHEMBL27357244 0.82 ALDH1A1 (0.53) HPGDKDM4EHSD17B10ALDH1A1GLA
Hydrochloric Acid SCHEMBL5403782 0.81 CA12 (0.56) HPGDKDM4EHSD17B10ALDH1A1GLA
SCHEMBL5404802 0.81 ALDH1A1 (0.52) HPGDKDM4EHSD17B10ALDH1A1GLA
SCHEMBL10935027 0.81 ALDH1A1 (0.52) HPGDKDM4EHSD17B10ALDH1A1GLA
SCHEMBL4799007 0.79 ALDH1A1 (0.50) HPGDKDM4EHSD17B10ALDH1A1GLA
SCHEMBL9617692 0.79 ALDH1A1 (0.50) HPGDKDM4EHSD17B10ALDH1A1GLA
SCHEMBL30874084 0.79 WDR5 (0.51) HPGDKDM4EHSD17B10ALDH1A1GLA

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-20090306201-A1 SELECTIVE INHIBITORS FOR TRANSFERASES UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2009-12-10 US disclosed
WO-2007149782-A2 SELECTIVE INHIBITORS FOR TRANSFERASES UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2007-12-27 WO 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-20090306201-A1 SELECTIVE INHIBITORS FOR TRANSFERASES TYMP, PCNA, TK1 HPGD 1089/4885KDM4E 1337/4885HSD17B10 543/4885

“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.