SCHEMBL2459680

SCHEMBL2459680

C(=C/c1c[nH]c2ccccc12)\c1ccsc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.55
RAB9A P51151 5/20 0.55
KMT2A Q03164 5/20 0.55
NPC1 O15118 4/20 0.55
USP2 O75604 3/20 0.55
MAPT P10636 3/20 0.55
LMNA P02545 2/20 0.55
ALDH1A1 P00352 2/20 0.55
CRHBP P24387 1/20 0.55
CRHR2 Q13324 1/20 0.55
APOBEC3A P31941 1/20 0.51
APOBEC3G Q9HC16 1/20 0.51
CYP2A6 P11509 1/20 0.49
IMPDH2 P12268 1/20 0.49
NQO2 P16083 2/20 0.47
NR0B1 P51843 1/20 0.47
HPGD P15428 2/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46

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
SCHEMBL2459684 1.00 MEN1 (0.55) MEN1RAB9AKMT2ANPC1USP2
SCHEMBL30869156 0.81 MEN1 (0.71) MEN1RAB9AKMT2ANPC1USP2
SCHEMBL10489040 0.81 CYP2A6 (0.69) MEN1RAB9AKMT2ANPC1USP2
SCHEMBL2461963 0.80 RAB9A (0.69) MEN1RAB9AKMT2ANPC1USP2
SCHEMBL2461966 0.80 RAB9A (0.69) MEN1RAB9AKMT2ANPC1USP2
SCHEMBL22645551 0.77 MEN1 (0.43) MEN1RAB9AKMT2ANPC1USP2
SCHEMBL22645549 0.77 MEN1 (0.43) MEN1RAB9AKMT2ANPC1USP2
SCHEMBL2604943 0.77 MEN1 (0.60) MEN1RAB9AKMT2ANPC1USP2
SCHEMBL2458798 0.76 MEN1 (0.52) MEN1RAB9AKMT2ANPC1USP2
SCHEMBL2458800 0.76 MEN1 (0.52) MEN1RAB9AKMT2ANPC1USP2

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 MEN1 2613/4885RAB9A 3044/4885KMT2A 4354/4885

“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.