SCHEMBL7694474

SCHEMBL7694474

[O]CCCCCc1cccc2cc3ccccc3cc12

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 9/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
NQO2 P16083 1/20 0.38
MTNR1B P49286 6/20 0.38
GPR84 Q9NQS5 1/20 0.38
SLC16A3 O15427 1/20 0.36

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
SCHEMBL7690978 1.00 MTNR1A (0.41) MTNR1AKDM4EALDH1A1GAANQO2
SCHEMBL27695213 0.98 MTNR1A (0.40) MTNR1AKDM4EALDH1A1GAANQO2
SCHEMBL7692450 0.98 MTNR1A (0.42) MTNR1AKDM4EALDH1A1GAANQO2
SCHEMBL7691848 0.95 MTNR1A (0.42) MTNR1AKDM4EALDH1A1GAANQO2
SCHEMBL1567131 0.87 ALDH1A1 (0.43) MTNR1AKDM4EALDH1A1GAANQO2
SCHEMBL7643869 0.85 MTNR1A (0.47) MTNR1ANQO2GPR84SLC16A3
SCHEMBL129449 0.85 MTNR1A (0.47) MTNR1ANQO2GPR84SLC16A3
SCHEMBL12981740 0.85 MTNR1A (0.47) MTNR1ANQO2GPR84SLC16A3
SCHEMBL128593 0.85 MTNR1A (0.47) MTNR1ANQO2GPR84SLC16A3
SCHEMBL12982184 0.85 MTNR1A (0.47) MTNR1ANQO2GPR84SLC16A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002000622-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 WO disclosed