SCHEMBL2459910

SCHEMBL2459910

c1cc2ccc(-c3cn[nH]c3)cc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.48
MAPK1 P28482 3/20 0.46
CHEK1 O14757 3/20 0.44
BRD4 O60885 1/20 0.44
AKT1 P31749 1/20 0.44
AKT2 P31751 1/20 0.44
PIP4K2A P48426 1/20 0.44
PIP4K2B P78356 1/20 0.44
FLT3 P36888 3/20 0.43
PIM1 P11309 2/20 0.43
PIM3 Q86V86 2/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 1/20 0.43
PLK4 O00444 1/20 0.43
PDPK1 O15530 1/20 0.43
DYRK3 O43781 1/20 0.43
JAK2 O60674 1/20 0.43
ROCK2 O75116 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
SCHEMBL30574690 1.00 GHSR (0.48) GHSRMAPK1CHEK1BRD4AKT1
SCHEMBL2457387 0.88 NPC1 (0.58) MAPK1CHEK1BRD4AKT1AKT2
SCHEMBL30423371 0.77 AKT2 (0.54) MAPK1AKT1AKT2FLT3PIM1
SCHEMBL2461196 0.77 FGFR1 (0.64) MAPK1CHEK1FLT3PIM1PIM3
SCHEMBL27361728 0.75 BRD4 (0.46) MAPK1BRD4PIP4K2APIP4K2BMEN1
SCHEMBL2458580 0.73 AHR (0.47) MAPK1BRD4PIP4K2APIP4K2BMEN1
SCHEMBL2458568 0.73 AKT2 (0.59) AKT1AKT2PIM1PIM3NPC1
SCHEMBL18000228 0.73 BRAF (0.58) GHSRBRD4PIP4K2APIP4K2BNPC1
SCHEMBL12676643 0.72 BRD4 (0.44) MAPK1BRD4MEN1POLBKMT2A
SCHEMBL16432987 0.72 AKT2 (0.76) AKT1AKT2PIM1PIM3ROCK2

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 GHSR 48/4885MAPK1 1952/4885CHEK1 2771/4885

“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.