SCHEMBL10076246

SCHEMBL10076246

CCc1ccc(C(=O)NCc2cccnc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.74
LMNA P02545 5/20 0.73
ALDH1A1 P00352 3/20 0.73
HTT P42858 3/20 0.73
MAPT P10636 1/20 0.73
MAPK1 P28482 1/20 0.72
GAA P10253 1/20 0.71
TSHR P16473 1/20 0.69
POLB P06746 3/20 0.68
HPGD P15428 2/20 0.68
GLA P06280 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
MMP13 P45452 1/20 0.67
CA2 P00918 1/20 0.66
NPSR1 Q6W5P4 1/20 0.65
NAMPT P43490 1/20 0.64
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64

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
SCHEMBL8372128 0.87 TSHR (0.74) TRPV1LMNAALDH1A1HTTMAPT
SCHEMBL29437161 0.87 MMP13 (0.85) TRPV1LMNAALDH1A1HTTMAPT
SCHEMBL13102334 0.87 MMP13 (0.85) TRPV1LMNAALDH1A1HTTMAPT
SCHEMBL13766380 0.86 HDAC2 (0.63) TRPV1LMNAALDH1A1HTTMAPT
SCHEMBL14030202 0.86 L3MBTL1 (0.64) TRPV1LMNAALDH1A1HTTMAPT
SCHEMBL5257811 0.85 LMNA (0.72) TRPV1LMNAALDH1A1HTTMAPT
SCHEMBL6569317 0.85 LMNA (0.72) TRPV1LMNAALDH1A1HTTMAPT
SCHEMBL12334915 0.85 POLB (0.86) TRPV1ALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL1161997 0.85 NAMPT (0.75) TRPV1LMNAALDH1A1HTTMAPT
SCHEMBL1568226 0.85 ALDH1A1 (0.72) TRPV1LMNAALDH1A1HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093231-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2012-01-10 US disclosed
US-7667036-B2 MAPKAP-K2 (mitogen-activated protein kinase-activated protein kinase 2) inhibitors; inflammatory, autoimmune disease, destructive bone disorder, cancer and/or tumor growth; angiogenesis, diabetes and neurological disorders TEIJIN PHARMA LIMITED (JP) 2010-02-23 US disclosed
US-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES TELIK, INC. 2008-02-14 US disclosed
US-7262182-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2007-08-28 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-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES MTAP, TYMP, PHOSPHO1 TRPV1 3876/4885LMNA 3943/4885ALDH1A1 4455/4885

“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.