SCHEMBL10691960

SCHEMBL10691960

CC12SCCN1C(=O)N(c1ccccc1)C2=O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.42
ALDH1A1 P00352 6/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PGR P06401 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MGLL Q99685 1/20 0.34

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
SCHEMBL11259364 0.81 TSHR (0.47) ELANEALDH1A1MEN1KMT2A
SCHEMBL11654508 0.69 PGR (0.58) ELANEALDH1A1PGRCACNA1BAPBA1
SCHEMBL25269266 0.67 OPRM1 (0.38) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL9220461 0.66 NPC1 (0.42) ALDH1A1PGRMEN1KMT2ANPC1
SCHEMBL17716274 0.65 ELANE (0.52) ELANEALDH1A1PGRMEN1KMT2A
SCHEMBL19923441 0.65 GRM4 (0.57) ELANEALDH1A1PGRCACNA1BAPBA1
SCHEMBL10948887 0.65 ELANE (0.63) ELANEALDH1A1PGRCACNA1BAPBA1
SCHEMBL22745971 0.65 ELANE (0.61) ELANEALDH1A1PGRMEN1KMT2A
SCHEMBL11730058 0.64 PGR (0.51) ELANEALDH1A1PGRCACNA1BAPBA1
SCHEMBL10529926 0.64 HTR1A (0.36) ALDH1A1SMN1; SMN2CYP2C19

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-0133970-A2 Compounds with antidotal activity for the defence of cultivations of agrarian interest from the action of non-selective weed-killers Montedison S.p.A. (IT) 1985-03-13 EP claimed
US-4793851-A PLANT SAFENING AGENTS MONTEDISON S.P.A. (IT) 1988-12-27 US disclosed