SCHEMBL2457533

SCHEMBL2457533

c1c[nH]c(-c2ccc3nc[nH]c3c2)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 11/20 0.54
QPCTL Q9NXS2 4/20 0.54
PRKCI P41743 2/20 0.49
KDM4E B2RXH2 2/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
TP53 P04637 1/20 0.49
HPGD P15428 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPT P10636 1/20 0.47
RAD52 P43351 1/20 0.47
BRD4 O60885 1/20 0.47
CREBBP Q92793 1/20 0.47
MMP12 P39900 1/20 0.45
CYP3A4 P08684 1/20 0.44
NAMPT P43490 1/20 0.44
XDH P47989 1/20 0.44
PSMD11 O00231 1/20 0.43

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
SCHEMBL2455532 0.86 QPCT (0.40) QPCTQPCTLPRKCIKDM4ENPC1
SCHEMBL8634290 0.81 QPCT (0.68) QPCTQPCTLPRKCIKDM4ENPC1
SCHEMBL2462345 0.77 QPCT (0.68) QPCTQPCTLPRKCIKDM4ENPC1
SCHEMBL991449 0.76 QPCT (0.58) QPCTQPCTLPRKCIKDM4ESMN1; SMN2
SCHEMBL23227763 0.75 QPCT (0.60) QPCTQPCTLPRKCIKDM4ENPC1
SCHEMBL29804755 0.75 QPCT (0.60) QPCTQPCTLPRKCIKDM4ENPC1
SCHEMBL2474515 0.74 QPCT (0.60) QPCTQPCTLPRKCIKDM4ENPC1
SCHEMBL22418756 0.74 QPCT (0.64) QPCTQPCTLPRKCIKDM4ENPC1
SCHEMBL28190281 0.74 QPCT (0.64) QPCTQPCTLPRKCIKDM4ENPC1
SCHEMBL23207344 0.73 QPCT (0.55) QPCTQPCTLPRKCIKDM4ENPC1

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-20110237633-A1 SMALL MOLECULE MODULATORS OF HEPATOCYTE GROWTH FACTOR (SCATTER FACTOR) ACTIVITY NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2011-09-29 US disclosed
WO-2010068287-A2 SMALL MOLECULE MODULATORS OF HEPATOCYTE GROWTH FACTOR (SCATTER FACTOR) ACTIVITY ANGION BIOMEDICA CORP. (US) 2010-06-17 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-20110237633-A1 SMALL MOLECULE MODULATORS OF HEPATOCYTE GROWTH FACTOR (SCATTER FACTOR) ACTIVITY HGF, HDGF, MET QPCT 3492/4885QPCTL 4285/4885PRKCI 1031/4885

“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.