SCHEMBL9909208

SCHEMBL9909208

COC(=O)c1ccc2nccc(-c3ccc(C#N)cc3OC)c2c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 6/20 0.51
GAK O14976 2/20 0.47
RIPK2 O43353 2/20 0.47
COQ8A Q8NI60 2/20 0.47
NLK Q9UBE8 2/20 0.47
CCNT1 O60563 1/20 0.46
CDK9 P50750 1/20 0.46
ALOX15 P16050 1/20 0.43
HTT P42858 1/20 0.43
PDE5A O76074 1/20 0.42
KDM5A P29375 1/20 0.42
KDM5B Q9UGL1 1/20 0.42
EGLN1 Q9GZT9 4/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
CDK8 P49336 1/20 0.40
TGFBR1 P36897 1/20 0.40

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
SCHEMBL9909156 0.90 SCN9A (0.49) SCN9AGAKRIPK2COQ8ANLK
SCHEMBL9909299 0.85 SCN9A (0.45) SCN9AGAKRIPK2COQ8ANLK
SCHEMBL9909216 0.84 EGLN2 (0.47) GAKRIPK2COQ8ANLKALOX15
SCHEMBL9909202 0.82 HTT (0.51) SCN9ACCNT1CDK9ALOX15HTT
SCHEMBL12875034 0.81 SCN9A (0.43) SCN9AGAKRIPK2COQ8ANLK
SCHEMBL9909169 0.81 PDE5A (0.45) SCN9APDE5AEGLN1MRGPRX4
SCHEMBL16509518 0.80 CYP11B1 (0.43) SCN9AEGLN1MRGPRX4
SCHEMBL16502433 0.80 PLAU (0.49) SCN9AEGLN1MRGPRX4
SCHEMBL9909186 0.79 ALOX15 (0.48) CCNT1CDK9ALOX15HTTTGFBR1
SCHEMBL6301162 0.78 ALOX15 (0.57) ALOX15HTTTGFBR1

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-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
EP-2463276-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2012-06-13 EP disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US disclosed
WO-2011016504-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE アステラス製薬株式会社 (JP) 2011-02-10 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-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE HTR5A, HTR2A, HTR1E SCN9A 412/4885GAK 1532/4885RIPK2 2038/4885

“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.