SCHEMBL9048469

SCHEMBL9048469

NC(=O)C(c1ccccc1C(=O)c1ccccc1)C1CCCc2c(C(=O)C(=O)O)cccc21

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 3/20 0.34
AKR1C3 P42330 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34
SCN1A P35498 1/20 0.33
SCN5A Q14524 1/20 0.33
SCN9A Q15858 1/20 0.33
HSD11B1 P28845 1/20 0.33
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
FFAR1 O14842 1/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PKM P14618 1/20 0.32
CCR6 P51684 1/20 0.32
ATM Q13315 1/20 0.32
TLR9 Q9NR96 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL9567990 0.83 TRPM8 (0.47) TRPM8HSD11B1ALDH1A1LMNA
SCHEMBL9046594 0.82 PTGIR (0.36) TRPM8NPSR1SCN1ASCN5ASCN9A
SCHEMBL9048474 0.82 PTGIR (0.36) SCN1ASCN5ASCN9A
SCHEMBL9048479 0.82 PTGIR (0.50) SCN1ASCN5ASCN9A
SCHEMBL9427074 0.76 TRPM8 (0.35) TRPM8HSD11B1ALDH1A1PKM
SCHEMBL9048929 0.75 TDP1 (0.36) TRPM8ALDH1A1LMNATDP1
SCHEMBL9050469 0.74 KMT2A (0.36) TRPM8ALDH1A1TDP1
SCHEMBL9047990 0.74 EPHX1 (0.36) TRPM8
SCHEMBL11636914 0.72 SIRT1 (0.44) TRPM8AKR1C3GAAMAPTALDH1A1
SCHEMBL9050555 0.71 NPSR1 (0.47) NPSR1ALDH1A1HPGDPKM

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-0542203-B1 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO (JP) 1996-07-03 EP claimed
US-5344836-A Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-09-06 US claimed