SCHEMBL7270673

SCHEMBL7270673

CC(=O)NC1CCc2ccccc2C1O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.53
MTNR1B P49286 5/20 0.53
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PDPK1 O15530 1/20 0.44
TAS1R3 Q7RTX0 2/20 0.43
TAS1R1 Q7RTX1 2/20 0.43
TAS1R2 Q8TE23 2/20 0.43
BLM P54132 1/20 0.43
TSHR P16473 1/20 0.43
SLC18A3 Q16572 1/20 0.42
HTT P42858 1/20 0.41
GRM7 Q14831 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL7273542 1.00 MTNR1A (0.53) MTNR1AMTNR1BSMN1; SMN2NPSR1PDPK1
SCHEMBL11138133 1.00 MTNR1A (0.53) MTNR1AMTNR1BSMN1; SMN2NPSR1PDPK1
SCHEMBL30685626 0.86 HTT (0.46) NPSR1PDPK1TAS1R3TAS1R1TAS1R2
SCHEMBL30685627 0.86 HTT (0.46) NPSR1PDPK1TAS1R3TAS1R1TAS1R2
SCHEMBL23772365 0.84 MTNR1A (0.53) MTNR1AMTNR1BSMN1; SMN2NPSR1PDPK1
SCHEMBL24011024 0.84 CNR1 (0.50) MTNR1AMTNR1BSMN1; SMN2NPSR1GRM7
SCHEMBL2464892 0.83 MTNR1A (0.51) MTNR1AMTNR1BSMN1; SMN2NPSR1PDPK1
SCHEMBL696008 0.81 ALDH1A1 (0.60) MTNR1AMTNR1BTAS1R3TAS1R1TAS1R2
SCHEMBL9854709 0.81 MTNR1A (0.49) MTNR1AMTNR1BSMN1; SMN2NPSR1PDPK1
SCHEMBL697600 0.81 ALDH1A1 (0.60) MTNR1AMTNR1BTAS1R3TAS1R1TAS1R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4420480-A PARKINSONISM, DEPRESSION, HYPOTENSIVES MERCK & CO., INC. (US) 1983-12-13 US disclosed
EP-0080115-A2 Hexahydronaphth(1,2-b)-1,4-oxazines, process for their preparation and pharmaceutical formulation containing them MERCK & CO. INC. (US) 1983-06-01 EP disclosed
US-4207241-A ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS AND ANTIPRURITIC AGENTS SYNTEX CORPORATION (US) 1980-06-10 US disclosed
US-4097674-A ANTIINFLAMMATORY, ANTIPYRETIC, ANTIPRURITIC AGENTS, ANALGESICS SYNTEX CORPORATION (US) 1978-06-27 US disclosed
US-4051233-A ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC, ANTIPRURITIC SYNTEX CORPORATION (US) 1977-09-27 US disclosed
US-4048330-A Compositions containing 2-(6'-substituted-2'-naphthyl)acetic acid esters used for treating inflammation, pain or pyrexia SYNTEX CORPORATION (US) 1977-09-13 US disclosed
US-4009197-A 2-(6-Substituted-2'-naphthyl) acetic acid derivatives and the salts and esters thereof SYNTEX CORPORATION (PM) 1977-02-22 US disclosed
US-4001301-A ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS, ANTI-PRURITIC SYNTEX CORPORATION (PM) 1977-01-04 US disclosed
US-3998966-A Anti-inflammatory, analgesic, anti-pyretic and anti-pruritic 6-substituted 2-naphthyl acetic acid derivative-containing compositions and methods of use thereof SYNTEX CORPORATION (PM) 1976-12-21 US disclosed
US-3980699-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETIC, ANTIPRURITIC SYNTEX CORPORATION (PM) 1976-09-14 US disclosed
US-3978124-A ANALGESIC, ANTIPYRETIC SYNTEX CORPORATION (PM) 1976-08-31 US disclosed
US-3978116-A ANALGESIC, ANTIPYRETIC SYNTEX CORPORATION (PM) 1976-08-31 US disclosed