SCHEMBL5453434

SCHEMBL5453434

N#Cc1cccnc1NC(=O)N1CCN(c2ccc(NC(=O)Nc3ccccc3OC(F)F)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
PANK3 Q9H999 4/20 0.47
P2RY1 P47900 4/20 0.45
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
MAPT P10636 3/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GLA P06280 1/20 0.41
KDM4E B2RXH2 2/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TP53 P04637 1/20 0.40
NAMPT P43490 1/20 0.39

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
SCHEMBL5459054 0.89 MEN1 (0.48) KMT2AMEN1PANK3P2RY1CA12
SCHEMBL5465480 0.88 KMT2A (0.63) KMT2AMEN1PANK3P2RY1CA12
SCHEMBL5451017 0.88 GFER (0.50) KMT2AP2RY1MAPTNPC1RAB9A
SCHEMBL5466982 0.84 MAPT (0.47) KMT2AMEN1PANK3P2RY1CA12
SCHEMBL5467032 0.82 PANK3 (0.46) KMT2AMEN1PANK3P2RY1CA12
SCHEMBL5460053 0.81 GLA (0.48) KMT2APANK3P2RY1CA12CA1
SCHEMBL5454308 0.81 NAMPT (0.50) KMT2AMEN1PANK3CA12CA1
SCHEMBL5459962 0.81 PANK3 (0.47) KMT2AMEN1PANK3P2RY1CA12
SCHEMBL5458442 0.80 MAPT (0.47) KMT2AMEN1PANK3CA12CA1
SCHEMBL5469441 0.79 PANK3 (0.45) KMT2AMEN1PANK3P2RY1CA12

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070249620-A1 Urea Derivative SANKYO COMPANY, LIMITED (JP) 2007-10-25 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-20070249620-A1 Urea Derivative UGP2, SLC14A1, DGAT1 KMT2A 1350/4885MEN1 1828/4885PANK3 3325/4885

“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.