SCHEMBL9150606

SCHEMBL9150606

O=C(O)CCCc1cn(C(=O)c2cccc(NC(c3ccc(Cl)cc3)c3ccc(Cl)cc3)c2)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 1/20 0.49
SRD5A2 P31213 1/20 0.49
OXER1 Q8TDS5 1/20 0.45
MCL1 Q07820 2/20 0.39
AKR1C3 P42330 3/20 0.39
AKR1C2 P52895 2/20 0.39
PTGS2 P35354 1/20 0.39
KMT2A Q03164 3/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
ADRA1D P25100 2/20 0.38
ADRA1A P35348 1/20 0.37
AKR1C4 P17516 1/20 0.37
PTGS1 P23219 1/20 0.37
ABCB1 P08183 2/20 0.37
HTR1A P08908 1/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
HTR1F P30939 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
SCHEMBL9148425 0.88 SRD5A1 (0.64) SRD5A1SRD5A2OXER1PTGS2KMT2A
SCHEMBL9153190 0.85 SRD5A1 (0.64) SRD5A1SRD5A2OXER1PTGS2KMT2A
SCHEMBL9153111 0.85 SRD5A1 (0.55) SRD5A1SRD5A2OXER1AKR1C3AKR1C2
SCHEMBL9156270 0.85 SRD5A1 (0.63) SRD5A1SRD5A2OXER1PTGS2KMT2A
SCHEMBL9149618 0.84 SRD5A1 (0.55) SRD5A1SRD5A2OXER1KMT2AMEN1
SCHEMBL9149126 0.83 SRD5A1 (0.62) SRD5A1SRD5A2OXER1PTGS2KMT2A
SCHEMBL9150612 0.78 OXER1 (0.48) OXER1MCL1AKR1C3AKR1C2PTGS2
SCHEMBL5444461 0.78 OXER1 (0.64) OXER1MCL1PTGS2KMT2AADRA1D
SCHEMBL9429199 0.78 SRD5A1 (0.54) SRD5A1SRD5A2OXER1PTGS2KMT2A
SCHEMBL9368697 0.77 OXER1 (0.56) OXER1MCL1KMT2AMEN1ADRA1D

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 4 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