SCHEMBL659675

SCHEMBL659675

O=C(CN1C=CC(C(=O)NCCOC(=O)c2ccccc2)C=C1)Nc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.44
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
ALDH1A1 P00352 7/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MAPK1 P28482 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPT P10636 4/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 3/20 0.39
LMNA P02545 3/20 0.39
KDM4E B2RXH2 2/20 0.38
GAA P10253 2/20 0.38
ADRB2 P07550 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RAB9A P51151 1/20 0.37

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
SCHEMBL659961 0.86 TDP1 (0.42) NPSR1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL287525 0.79 ALDH1A1 (0.50) NPSR1ALDH1A1SMN1; SMN2TDP1MAPT
SCHEMBL6227338 0.70 NPSR1 (0.60) NPSR1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL287312 0.70 CHRNB2 (0.44) KMT2AMEN1ALDH1A1TDP1HPGD
Hydrochloric Acid SCHEMBL1194141 0.69 NPSR1 (0.58) NPSR1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL7603207 0.68 TDP1 (0.63) NPSR1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL10996044 0.67 ALDH1A1 (0.63) NPSR1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL13100724 0.67 HPGD (0.74) NPSR1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL12088129 0.67 TDP1 (0.61) NPSR1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL28322559 0.66 LMNA (0.62) NPSR1KMT2AMEN1ALDH1A1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046317-A1 NOVEL HETEROCYCLIC COMPOUNDS DUTT CHAITANYA (IN) 2012-02-23 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-20120046317-A1 NOVEL HETEROCYCLIC COMPOUNDS AGER, REN, AGT NPSR1 3243/4885KMT2A 4512/4885MEN1 1455/4885

“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.