SCHEMBL2461079

SCHEMBL2461079

C(=C/c1ccns1)\c1nc2ccccc2[nH]1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.58
NPC1 O15118 8/20 0.58
RAB9A P51151 8/20 0.58
KDM4E B2RXH2 8/20 0.58
SMN1; SMN2 Q16637 6/20 0.58
MEN1 O00255 6/20 0.58
KMT2A Q03164 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 3/20 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
SCHEMBL2461081 1.00 ALDH1A1 (0.58) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL29539476 0.82 ALDH1A1 (0.81) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL1086983 0.82 ALDH1A1 (0.81) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL1086985 0.82 ALDH1A1 (0.81) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL2458817 0.77 NPC1 (0.59) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL2458821 0.77 NPC1 (0.59) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL31305038 0.75 NPC1 (0.89) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL537904 0.74 NPC1 (1.00) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL29660212 0.74 NPC1 (1.00) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL537905 0.74 NPC1 (1.00) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2

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

“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.