SCHEMBL16290873

SCHEMBL16290873

Nc1cc(OCC2CCCC2)ncn1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 10/20 0.43
CCNA2 P20248 6/20 0.43
CCNA1 P78396 6/20 0.43
CDK1 P06493 5/20 0.43
MCHR1 Q99705 3/20 0.42
CCNB1 P14635 2/20 0.38
AHCY P23526 1/20 0.38
CCNB2 O95067 1/20 0.38
MAPK3 P27361 1/20 0.38
CLK1 P49759 1/20 0.38
CDK5 Q00535 1/20 0.38
PIN1 Q13526 1/20 0.38
CCNB3 Q8WWL7 1/20 0.38
MAP3K5 Q99683 1/20 0.38
PARP15 Q460N3 1/20 0.37
PARP10 Q53GL7 1/20 0.37
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36

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
SCHEMBL16290891 0.97 MCHR1 (0.42) CDK2CCNA2CCNA1CDK1MCHR1
SCHEMBL16290804 0.93 CDK2 (0.37) CDK2CCNA2CCNA1CDK1MCHR1
SCHEMBL15114932 0.81 CDK2 (0.41) CDK2CCNA2CCNA1CDK1MCHR1
SCHEMBL6260791 0.77 CDK2 (0.53) CDK2CCNA2CCNA1CDK1MCHR1
SCHEMBL558400 0.75 LOX (0.47) CDK2MCHR1ALOX5APFEN1
SCHEMBL22247294 0.71 KMO (0.40) PARP15PARP10
SCHEMBL16290592 0.71 LOX (0.44) MCHR1ALOX5APFEN1
SCHEMBL38664609 0.71 LOX (0.39) MCHR1ALOX5APFEN1
SCHEMBL24692145 0.70 KDM5B (0.36) CDK2MCHR1FEN1
SCHEMBL10188104 0.70 ALDH1A1 (0.39) ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9458152-B2 Bicyclic sulfonamide compounds as sodium channel inhibitors AMGEN INC. (US) 2016-10-04 US disclosed
US-9458152-B2 Bicyclic sulfonamide compounds as sodium channel inhibitors AMGEN INC. (US) 2016-10-04 US disclosed
US-9458152-B2 Bicyclic sulfonamide compounds as sodium channel inhibitors AMGEN INC. (US) 2016-10-04 US disclosed
US-20160046626-A1 BICYCLIC SULFONAMIDE COMPOUNDS AS SODIUM CHANNEL INHIBITORS AMGEN INC. 2016-02-18 US disclosed
US-9212182-B2 Bicyclic sulfonamide compounds as sodium channel inhibitors AMGEN INC. (US) 2015-12-15 US disclosed
US-9212182-B2 Bicyclic sulfonamide compounds as sodium channel inhibitors AMGEN INC. (US) 2015-12-15 US disclosed
US-9212182-B2 Bicyclic sulfonamide compounds as sodium channel inhibitors AMGEN INC. (US) 2015-12-15 US disclosed
US-20140371201-A1 BICYCLIC SULFONAMIDE COMPOUNDS AS SODIUM CHANNEL INHIBITORS AMGEN INC. 2014-12-18 US disclosed
US-20140371201-A1 BICYCLIC SULFONAMIDE COMPOUNDS AS SODIUM CHANNEL INHIBITORS AMGEN INC. 2014-12-18 US disclosed
WO-2014201206-A1 BICYCLIC SULFONAMIDE COMPOUNDS AS SODIUM CHANNEL INHIBITORS AMGEN INC. (US) 2014-12-18 WO disclosed
US-20140371201-A1 BICYCLIC SULFONAMIDE COMPOUNDS AS SODIUM CHANNEL INHIBITORS AMGEN INC. 2014-12-18 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 (2 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-20140371201-A1 BICYCLIC SULFONAMIDE COMPOUNDS AS SODIUM CHANNEL INHIBITORS SCN7A, TRPV1, TRPV5 CDK2 2445/4885CCNA2 4135/4885CCNA1 3817/4885
US-20160046626-A1 BICYCLIC SULFONAMIDE COMPOUNDS AS SODIUM CHANNEL INHIBITORS SCN7A, TRPV1, TRPV5 CDK2 2445/4885CCNA2 4135/4885CCNA1 3817/4885

“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.