SCHEMBL8345138

SCHEMBL8345138

CCOC(=O)c1[nH]c(-c2ccc(Cl)cc2)nc1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.59
SIRT1 Q96EB6 1/20 0.59
SIRT3 Q9NTG7 1/20 0.59
ALPL P05186 1/20 0.50
TARBP2 Q15633 1/20 0.50
MAPT P10636 1/20 0.49
TRPM8 Q7Z2W7 1/20 0.49
GABRA2 P47869 2/20 0.48
GABRB2 P47870 2/20 0.48
TP53 P04637 1/20 0.48
MDM2 Q00987 1/20 0.48
GCGR P47871 1/20 0.47
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 2/20 0.46
HPGD P15428 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
ALOX15 P16050 2/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL15442034 0.86 HSD17B10 (0.59) MAPTTRPM8TP53MDM2ALDH1A1
SCHEMBL28297288 0.85 GAA (0.58) TARBP2MAPTGABRA2GABRB2TP53
SCHEMBL8026733 0.83 SIRT2 (0.56) SIRT2SIRT1SIRT3ALPLTARBP2
SCHEMBL8342056 0.81 MAPK1 (0.50) SIRT2SIRT1SIRT3GCGRKDM4E
SCHEMBL8036853 0.76 SIRT2 (0.54) SIRT2SIRT1SIRT3ALPLTARBP2
SCHEMBL4007745 0.76 SIRT2 (0.48) SIRT2SIRT1SIRT3ALPLTARBP2
SCHEMBL4604916 0.75 ALPL (0.56) SIRT2SIRT1SIRT3ALPLTARBP2
SCHEMBL28746458 0.75 MAPT (0.42) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL26659457 0.74 ALDH1A1 (0.47) ALDH1A1KDM4EHPGDKMT2AMEN1
SCHEMBL20567843 0.74 ALOX5 (0.63) SIRT2SIRT1SIRT3MAPTTRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5888941-A Carbozamides with antifungal activity J. URIACH & CIA. S.A. (ES) 1999-03-30 US disclosed
EP-0783502-A1 NEW CARBOXAMIDES WITH ANTIFUNGAL ACTIVITY J. URIACH & CIA. S.A. (ES) 1997-07-16 EP disclosed
WO-1997005131-A1 NEW CARBOXAMIDES WITH ANTIFUNGAL ACTIVITY J. URIACH & CIA. S.A. (ES) 1997-02-13 WO disclosed