SCHEMBL1509486

SCHEMBL1509486

Oc1ncc2c(n1)-c1ccccc1OC2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.53
KDM4E B2RXH2 11/20 0.53
MAPT P10636 8/20 0.53
HPGD P15428 7/20 0.53
GAA P10253 3/20 0.53
RCE1 Q9Y256 1/20 0.53
RECQL P46063 1/20 0.49
KMT2A Q03164 2/20 0.46
MAPK1 P28482 3/20 0.44
LMNA P02545 2/20 0.44
TP53 P04637 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
THRB P10828 2/20 0.41
RAB9A P51151 1/20 0.40
HSD17B10 Q99714 3/20 0.40
ALPL P05186 1/20 0.40
POLB P06746 1/20 0.40
MEN1 O00255 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL15933176 0.81 ALDH1A1 (0.56) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL10220365 0.79 ALDH1A1 (0.51) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL10271457 0.78 ALDH1A1 (0.50) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL1509559 0.77 KDM4E (0.65) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL8326923 0.75 KDM4E (0.61) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL1509445 0.74 KDM4E (0.57) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL13436146 0.74 ALDH1A1 (0.47) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL14059503 0.70 KMT2A (0.47) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL558437 0.70 KMT2A (0.47) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL29615690 0.70 KDM4E (0.61) ALDH1A1KDM4EMAPTHPGDGAA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 US disclosed
EP-2298770-A1 Heterocyclic compounds as TrkA modulators ChemBridge Corporation (US) 2011-03-23 EP disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 US disclosed
EP-1960382-A1 HETEROCYCLIC COMPOUNDS AS TYROSINE KINASE MODULATORS ChemBridge Research Laboratories, Inc. (US) 2008-08-27 EP disclosed
WO-2007056155-A1 HETEROCYCLIC COMPOUNDS AS TYROSINE KINASE MODULATORS CHEMBRIDGE RESEARCH LABORATORIES, INC. (US) 2007-05-18 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-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders LCK, MALT1, MYD88 ALDH1A1 2293/4885KDM4E 2432/4885MAPT 3154/4885

“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.