SCHEMBL2458237

SCHEMBL2458237

c1c[nH]c(-c2ccc3cnsc3c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.40
PIM1 P11309 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
PFKFB3 Q16875 1/20 0.34
CHEK1 O14757 6/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
TRPM5 Q9NZQ8 2/20 0.33
KDR P35968 2/20 0.33
TRPA1 O75762 1/20 0.33
NT5E P21589 1/20 0.32
CDK2 P24941 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
MAP3K7 O43318 1/20 0.31

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
SCHEMBL2459132 0.87 ABL1 (0.40) ABL1PIM1PIM2CYP11B1CYP11B2
SCHEMBL2459020 0.77 CYP11B1 (0.57) CYP11B1CYP11B2
SCHEMBL26265589 0.74 ABL1 (0.49) ABL1CYP11B1CYP11B2HDAC1HDAC6
SCHEMBL2457426 0.74 NPC1 (0.49) ABL1JAK2
SCHEMBL2461821 0.73 DYRK1A (0.37) ABL1PIM1PIM2HDAC1HDAC6
SCHEMBL2457802 0.73 NISCH (0.45) ABL1TRPM5TRPA1
SCHEMBL26260211 0.73 ABL1 (0.44) ABL1CYP11B1CYP11B2HDAC1HDAC6
SCHEMBL2458951 0.72 TRPM5 (0.35) ABL1CHEK1SLC6A2SLC6A4SLC6A3
SCHEMBL2457364 0.71 ALDH1A1 (0.38) ABL1PIM1PIM2HDAC1HDAC6
SCHEMBL2455196 0.70 TRPM5 (0.32) SLC6A2SLC6A4SLC6A3TRPM5TRPA1

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 ABL1 836/4885PIM1 1476/4885PIM2 1776/4885

“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.