SCHEMBL9149154

SCHEMBL9149154

O=C(O)CCCc1c[nH]c2ccc(Cl)cc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.64
HSD17B10 Q99714 1/20 0.64
SLC6A4 P31645 2/20 0.60
HTR2A P28223 1/20 0.60
TRPM8 Q7Z2W7 1/20 0.60
MTNR1A P48039 1/20 0.60
MTNR1B P49286 1/20 0.60
HPGD P15428 1/20 0.58
CYP2C19 P33261 1/20 0.58
GPR84 Q9NQS5 1/20 0.58
MMP9 P14780 1/20 0.57
MMP8 P22894 1/20 0.57
MMP14 P50281 1/20 0.57
TSHR P16473 1/20 0.56
MPO P05164 3/20 0.56
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
TP53 P04637 1/20 0.55
MAPT P10636 1/20 0.55
KMT2A Q03164 1/20 0.55

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
SCHEMBL5343010 0.94 GFER (0.62) GFERHSD17B10SLC6A4HTR2ATRPM8
SCHEMBL892530 0.91 HPGD (0.69) GFERHSD17B10SLC6A4HTR2ATRPM8
SCHEMBL1614234 0.89 SLC6A4 (0.60) GFERHSD17B10SLC6A4HTR2ATRPM8
SCHEMBL27774062 0.87 GFER (0.53) GFERHSD17B10SLC6A4HTR2ATRPM8
SCHEMBL1270126 0.84 NPSR1 (0.68) HSD17B10SLC6A4HTR2AHPGDCYP2C19
SCHEMBL7238856 0.84 GFER (0.66) GFERHSD17B10SLC6A4HTR2ATRPM8
SCHEMBL10344751 0.83 MTNR1A (0.61) GFERSLC6A4HTR2AMTNR1AMTNR1B
SCHEMBL31173807 0.83 SLC6A4 (0.60) SLC6A4HTR2ATRPM8MTNR1AMTNR1B
SCHEMBL5203631 0.83 MPO (0.80) SLC6A4HTR2ATRPM8MTNR1AMTNR1B
SCHEMBL6365589 0.83 SLC6A4 (0.60) GFERHSD17B10SLC6A4HPGDCYP2C19

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
EP-0516849-B1 INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 1995-01-25 EP disclosed
US-5283251-A Testosterone 5a-reductase inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-02-01 US disclosed
EP-0516849-A1 INDOLE DERIVATIVES. FUJISAWA PHARMACEUTICAL CO (JP) 1992-12-09 EP disclosed
WO-1991013060-A1 INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-09-05 WO disclosed
CN-1054250-A INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 1991-09-04 CN disclosed