SCHEMBL7378701

SCHEMBL7378701

CC(C)(C)OC(=O)N[C@@]1(Cc2csc3c(Cl)nccc23)CCNC1=O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.37
P2RX7 Q99572 1/20 0.31
ADRA1A P35348 1/20 0.30
ADRA1B P35368 1/20 0.30
DRD2 P14416 1/20 0.30
SREBF2 Q12772 1/20 0.30
SPR P35270 1/20 0.30
LATS1 O95835 2/20 0.30

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
SCHEMBL7369204 0.86
SCHEMBL7378924 0.77 ACACB (0.38) P2RX7DRD2
SCHEMBL7376570 0.76 PPIA (0.38) ATRP2RX7
SCHEMBL7371166 0.73 SELE (0.40)
SCHEMBL7374454 0.73 PPIA (0.38)
SCHEMBL7375758 0.72 PPIA (0.43) P2RX7DRD2
SCHEMBL7375460 0.72 PPIA (0.44) P2RX7DRD2
SCHEMBL7376321 0.71 PPIA (0.33) ADRA1AADRA1B
SCHEMBL7424937 0.70 PPIA (0.38)
SCHEMBL7374752 0.70 MAP4K4 (0.41)

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
EP-1086099-A4 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARM PROD INC (US) 2002-01-02 EP disclosed
EP-1086099-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS Aventis Pharmaceuticals Products Inc. (US) 2001-03-28 EP disclosed
WO-1999062904-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-12-09 WO disclosed