SCHEMBL9205016

SCHEMBL9205016

CCCCCCCC([NH])CC

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
THRB P10828 1/20 0.44
LMNA P02545 1/20 0.44
DNM1 Q05193 2/20 0.43
OPRM1 P35372 1/20 0.42
GPR84 Q9NQS5 6/20 0.41
FFAR4 Q5NUL3 1/20 0.40
FFAR1 O14842 1/20 0.40
FDPS P14324 3/20 0.39

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
SCHEMBL9204736 1.00 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL7761948 1.00 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL1908388 1.00 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL9211953 1.00 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL9348824 1.00 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL9209820 1.00 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL7764683 1.00 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL9207718 1.00 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL9349389 1.00 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL277124 0.97

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-0421441-B1 Pantothenic acid derivatives FUJIREBIO KK (JP) 1995-01-25 EP disclosed
US-5120738-A Cardiovascular disorders FUJIREBIO INC. (JP) 1992-06-09 US disclosed