SCHEMBL9602307

SCHEMBL9602307

[O]CCNC(=O)Oc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
GAA P10253 1/20 0.55
HSD17B10 Q99714 1/20 0.53
FAAH O00519 1/20 0.52

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
SCHEMBL13055389 0.90 TAAR1 (0.60) TAAR1NPC1RAB9AGAAHSD17B10
SCHEMBL18389610 0.86
SCHEMBL9276339 0.86 TAAR1 (0.57) TAAR1NPC1RAB9AGAA
SCHEMBL989310 0.85
SCHEMBL21891729 0.85
SCHEMBL2243907 0.85 SMN1; SMN2 (0.63) TAAR1NPC1RAB9AGAAHSD17B10
SCHEMBL7786363 0.85
SCHEMBL8944700 0.83 TAAR1 (0.54) TAAR1NPC1RAB9AGAAHSD17B10
SCHEMBL1416061 0.83 HSD17B10 (0.55) TAAR1NPC1RAB9AGAAHSD17B10
SCHEMBL1895210 0.83 TAAR1 (0.58) TAAR1NPC1RAB9AGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0232623-B1 1-CARBACEPHALOSPORIN ANTIBIOTICS ELI LILLY AND COMPANY (US) 1993-03-17 EP disclosed
US-4892942-A 1-CARBA (DETHIA)CEPHALOSPORINS ELI LILLY AND COMPANY (US) 1990-01-09 US disclosed
US-4791106-A 1-Carbacephalosporin antibiotics ELI LILLY AND COMPANY (US) 1988-12-13 US disclosed
EP-0232623-A1 1-Carbacephalosporin antibiotics ELI LILLY AND COMPANY (US) 1987-08-19 EP disclosed