SCHEMBL3141272

SCHEMBL3141272

NC(=O)c1cccc(C[CH]C(=O)NCc2ccc(N)nc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.43
VNN1 O95497 3/20 0.43
F2 P00734 2/20 0.41
HDAC1 Q13547 2/20 0.41
NNMT P40261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NAMPT P43490 3/20 0.40
AURKA O14965 1/20 0.40
RPS6KB1 P23443 1/20 0.40
AURKB Q96GD4 1/20 0.40
ENPP2 Q13822 1/20 0.39
PRSS1 P07477 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38

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
SCHEMBL3153994 0.87 NNMT (0.49) VNN1F2HDAC1NNMTSMN1; SMN2
SCHEMBL3154319 0.84 MEN1 (0.40) VNN1F2HDAC1NAMPTPRSS1
SCHEMBL3154969 0.82 NAMPT (0.39) VNN1F2HDAC1NNMTSMN1; SMN2
SCHEMBL3140763 0.80 TSHR (0.44) HDAC1SMN1; SMN2NAMPTGABRPGABRD
SCHEMBL3149644 0.80 NAMPT (0.44) VNN1F2HDAC1NAMPTAURKA
SCHEMBL3157851 0.80 NAMPT (0.41) F2HDAC1NAMPTPRSS1GABRP
SCHEMBL3157640 0.79 KLKB1 (0.46) F2PRSS1KLKB1MASP2
SCHEMBL3154818 0.78 NAMPT (0.55) F2HDAC1NAMPTGABRPGABRD
SCHEMBL3140045 0.78 NAMPT (0.43) VNN1F2HDAC1NNMTSMN1; SMN2
SCHEMBL3139636 0.78 GABRP (0.40) VNN1F2HDAC1NNMTSMN1; SMN2

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-20100076015-A1 Aminopyridine Derivatives VANTIA LIMITED (GB) 2010-03-25 US disclosed
WO-2009133348-A1 AMINOPYRIDINE DERIVATIVES VANTIA LIMITED (GB) 2009-11-05 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-20100076015-A1 Aminopyridine Derivatives CHRM1, ARG1, ARG2 F10 2803/4885VNN1 3546/4885F2 1046/4885

“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.