SCHEMBL7975223

SCHEMBL7975223

COCOC1CCN(C(Cc2ccccc2)C(=O)N2CCC(OCOC(N)=O)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.47
REN P00797 6/20 0.43
KDM1A O60341 1/20 0.42
ALOX15 P16050 2/20 0.41
F2 P00734 1/20 0.41
PRSS1 P07477 1/20 0.41
GAA P10253 3/20 0.40
TSHR P16473 3/20 0.40
PLAU P00749 3/20 0.40
PLAUR Q03405 3/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CAPN1 P07384 1/20 0.40

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
SCHEMBL9494667 0.81 OPRD1 (0.55) RENF2PRSS1
SCHEMBL6163791 0.81 OPRD1 (0.55) RENF2PRSS1
SCHEMBL7352491 0.80 REN (0.51) HPGDRENGAAHSD17B10
SCHEMBL7352495 0.80 REN (0.51) HPGDRENGAAHSD17B10
SCHEMBL7317592 0.80 REN (0.51) HPGDRENGAAHSD17B10
SCHEMBL9442934 0.77 REN (0.59) REN
SCHEMBL7361787 0.77 REN (0.59) REN
SCHEMBL7317427 0.74 REN (0.47) REN
SCHEMBL7347289 0.74 KDM4E (0.49) RENGAATSHR
SCHEMBL9833483 0.73 REN (0.62) REN

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
US-6277877-B1 GLYCOGEN PHOSPHORYLASE INHIBITOR; ANTIDIABETIC AGENTS PFIZER, INC. 2001-08-21 US disclosed
US-6107329-A HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS PFIZER, INC. (US) 2000-08-22 US disclosed