SCHEMBL7761898

SCHEMBL7761898

CCCCCC([NH])CCCCC

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.48
TSHR P16473 1/20 0.44
THRB P10828 1/20 0.44
LMNA P02545 1/20 0.43
DNM1 Q05193 2/20 0.43
GPR84 Q9NQS5 6/20 0.41
FDPS P14324 3/20 0.40
FFAR4 Q5NUL3 1/20 0.39
FFAR1 O14842 1/20 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
SCHEMBL7769144 0.97 TSHR (0.50) OPRM1TSHRTHRBLMNADNM1
SCHEMBL7765585 0.97 TSHR (0.50) OPRM1TSHRTHRBLMNADNM1
SCHEMBL7766637 0.97 TSHR (0.50) OPRM1TSHRTHRBLMNADNM1
SCHEMBL1677972 0.97 DNM1 (0.48) OPRM1TSHRTHRBLMNADNM1
SCHEMBL1507445 0.97 TSHR (0.50) OPRM1TSHRTHRBLMNADNM1
SCHEMBL7764720 0.97 TSHR (0.50) OPRM1TSHRTHRBLMNADNM1
SCHEMBL7764680 0.97 TSHR (0.50) OPRM1TSHRTHRBLMNADNM1
SCHEMBL9211104 0.94 DNM1 (0.52) OPRM1TSHRTHRBLMNADNM1
SCHEMBL1125778 0.94 OPRM1 (0.50) OPRM1TSHRTHRBLMNADNM1
SCHEMBL3798118 0.91 OPRM1 (0.48) OPRM1TSHRTHRBLMNADNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001092420-A2 PERYLENE DYES WITH PERSISTENT FLUORESCENCE CAUSED BY STERIC INHIBITION OF AGGREGATION RADIANT COLOR N.V. (BE) 2001-12-06 WO claimed
WO-2001092420-A2 PERYLENE DYES WITH PERSISTENT FLUORESCENCE CAUSED BY STERIC INHIBITION OF AGGREGATION RADIANT COLOR N.V. (BE) 2001-12-06 WO disclosed
EP-1115695-A1 (R)-CHIRAL HALOGENATED 1-SUBSTITUTEDAMINO-(N+1)-ALKANOLS USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY Monsanto Company (US) 2001-07-18 EP disclosed
WO-2000018724-A1 (R)-CHIRAL HALOGENATED 1-SUBSTITUTEDAMINO-(n+1)-ALKANOLS USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY MONSANTO COMPANY (US) 2000-04-06 WO disclosed
WO-1999029707-A1 ALKYL AMINO DEOXY GLYCONIC ACID DERIVATIVES, PREPARATION AND USES CECA S.A. (FR) 1999-06-17 WO disclosed