SCHEMBL4664165

SCHEMBL4664165

Cc1cc(CCC(N)=O)nn1C

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.45
BAZ2B Q9UIF8 1/20 0.41
HTT P42858 4/20 0.41
ALDH1A1 P00352 5/20 0.41
LMNA P02545 4/20 0.41
HPGD P15428 2/20 0.40
CYP3A4 P08684 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
ALOX15 P16050 1/20 0.39
POLB P06746 1/20 0.39
KDM4E B2RXH2 2/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CAPN1 P07384 1/20 0.35

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
SCHEMBL13799647 0.84 NR1H4 (0.54) BCHEBAZ2BHTTALDH1A1LMNA
SCHEMBL3304144 0.82 BCHE (0.47) BCHEBAZ2BHTTALDH1A1LMNA
SCHEMBL13799645 0.80 TSHR (0.45) BCHEBAZ2BHTTALDH1A1LMNA
SCHEMBL24159031 0.76 P2RX7 (0.47) HTTALDH1A1LMNACYP3A4SMN1; SMN2
SCHEMBL9965045 0.74 BCHE (0.49) BCHEBAZ2BHTTALDH1A1LMNA
SCHEMBL13205786 0.73 BCHE (0.49) BCHEBAZ2BHTTALDH1A1LMNA
SCHEMBL21894060 0.72 BCHE (0.47) BCHEBAZ2BHTTALDH1A1LMNA
SCHEMBL292212 0.72 BCHE (0.47) BCHEBAZ2BHTTALDH1A1LMNA
SCHEMBL964527 0.72 BCHE (0.51) BCHEBAZ2BHTTALDH1A1LMNA
SCHEMBL7374141 0.71 KDM4E (0.47) ALDH1A1LMNASMN1; SMN2POLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2007717-A1 NOVEL SULFONAMIDE COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2008-12-31 EP claimed
WO-2007116374-A1 NOVEL SULFONAMIDE COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2007-10-18 WO claimed