SCHEMBL2459504

SCHEMBL2459504

C(=C/c1nc2ccccc2[nH]1)\c1ccon1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.58
RAB9A P51151 10/20 0.58
ALDH1A1 P00352 9/20 0.58
KMT2A Q03164 7/20 0.58
MEN1 O00255 6/20 0.58
KDM4E B2RXH2 7/20 0.58
SMN1; SMN2 Q16637 6/20 0.58
HPGD P15428 5/20 0.58
PKM P14618 4/20 0.58
HSP90AA1 P07900 1/20 0.58
MAPT P10636 5/20 0.52
LMNA P02545 4/20 0.52
GAA P10253 4/20 0.52
HTT P42858 3/20 0.52
NFKB1 P19838 2/20 0.52
NFKB2 Q00653 2/20 0.52
RELA Q04206 2/20 0.52
GLA P06280 2/20 0.52
TP53 P04637 2/20 0.52
RECQL P46063 1/20 0.52

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
SCHEMBL2459506 1.00 NPC1 (0.58) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL29539476 0.82 ALDH1A1 (0.81) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL1086983 0.82 ALDH1A1 (0.81) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL1086985 0.82 ALDH1A1 (0.81) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL2457794 0.78 ALDH1A1 (0.56) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL2457791 0.78 ALDH1A1 (0.56) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL709071 0.76 NPC1 (0.64) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL709072 0.76 NPC1 (0.64) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL31305038 0.75 NPC1 (0.89) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL2461291 0.75 ALDH1A1 (0.56) NPC1RAB9AALDH1A1KMT2AMEN1

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 NPC1 1244/4885RAB9A 3044/4885ALDH1A1 720/4885

“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.