SCHEMBL6402463

SCHEMBL6402463

COc1ccc(C(=O)NCc2cc(C(=O)Nc3ccccc3C#N)no2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
THRB P10828 1/20 0.48
F10 P00742 1/20 0.46
MAPT P10636 4/20 0.46
RXFP1 Q9HBX9 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
MAPK1 P28482 1/20 0.45
HSD17B10 Q99714 1/20 0.45
LMNA P02545 3/20 0.44
TP53 P04637 1/20 0.44
MAPK14 Q16539 2/20 0.44
RAB9A P51151 2/20 0.43
CYP3A4 P08684 1/20 0.43
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
PDE5A O76074 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
SCHEMBL6403049 0.86 MAPT (0.52) KMT2AMEN1THRBF10MAPT
SCHEMBL6408049 0.83 NPC1 (0.55) KMT2AMEN1MAPTRXFP1ALDH1A1
SCHEMBL6402541 0.82 RXFP1 (0.65) KMT2AMEN1THRBMAPTRXFP1
SCHEMBL6408618 0.81 SMN1; SMN2 (0.62) KMT2AMEN1MAPTRXFP1ALDH1A1
SCHEMBL6410111 0.79 SMN1; SMN2 (0.62) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL6403479 0.79 NPC1 (0.52) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL6405237 0.78 RAB9A (0.65) KMT2AMEN1THRBMAPTRXFP1
SCHEMBL6402530 0.78 KMT2A (0.54) KMT2AMEN1ALDH1A1HPGDNPSR1
SCHEMBL6407778 0.78 HSD17B10 (0.62) KMT2AMEN1MAPTRXFP1ALDH1A1
SCHEMBL6402547 0.78 SMN1; SMN2 (0.57) KMT2AMEN1MAPTRXFP1ALDH1A1

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-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide SDS BIOTECH K.K. (JP) 2005-08-04 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-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide AHR, ERG28, CYP1A2 KMT2A 986/4885MEN1 3154/4885THRB 2021/4885

“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.