SCHEMBL4575591

SCHEMBL4575591

COc1ccc(CC(=O)Nc2ccccn2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.68
MEN1 O00255 2/20 0.68
SLC6A2 P23975 1/20 0.68
SLC6A3 Q01959 1/20 0.68
SMN1; SMN2 Q16637 4/20 0.68
ALDH1A1 P00352 3/20 0.68
MAPK10 P53779 2/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
F2 P00734 1/20 0.64
RIOK2 Q9BVS4 2/20 0.64
GSK3A P49840 1/20 0.60
CDK5 Q00535 2/20 0.60
CDK5R1 Q15078 2/20 0.60
RAB9A P51151 2/20 0.59
MAPT P10636 1/20 0.59
KDM4E B2RXH2 3/20 0.59
LMNA P02545 1/20 0.59
CACNA1G O43497 1/20 0.58
CACNA1H O95180 1/20 0.58
CACNA1I Q9P0X4 1/20 0.58

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
SCHEMBL28585150 0.86 HTT (0.61) KMT2AMEN1SLC6A2SLC6A3SMN1; SMN2
SCHEMBL23355638 0.84 NPC1 (0.60) KMT2AMEN1SLC6A2SLC6A3SMN1; SMN2
SCHEMBL4908980 0.84 KMT2A (0.82) KMT2AMEN1SLC6A2SLC6A3SMN1; SMN2
SCHEMBL6490488 0.81 KMT2A (0.74) KMT2AMEN1SLC6A2SLC6A3SMN1; SMN2
Difenpiramide SCHEMBL29238669 0.81 KMT2A (1.00) KMT2AMEN1SLC6A2SLC6A3SMN1; SMN2
Difenpiramide SCHEMBL23833 0.81 KMT2A (1.00) KMT2AMEN1SLC6A2SLC6A3SMN1; SMN2
SCHEMBL29270879 0.81 KMT2A (1.00) KMT2AMEN1SLC6A2SLC6A3SMN1; SMN2
SCHEMBL31240699 0.80 MAPK10 (0.75) KMT2AMEN1SMN1; SMN2ALDH1A1MAPK10
SCHEMBL29083803 0.80 MAPK10 (0.75) KMT2AMEN1SMN1; SMN2ALDH1A1MAPK10
SCHEMBL16607690 0.80 F2 (0.85) KMT2AMEN1SMN1; SMN2ALDH1A1F2

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-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-20050137212-A1 Hppars activators SMITHKLINE BEECHAM CORPORATION 2005-06-23 US 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-20050137212-A1 Hppars activators PPARG, PPARA, PPARD KMT2A 4023/4885MEN1 4576/4885SLC6A2 3668/4885

“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.