SCHEMBL9334476

SCHEMBL9334476

CC(C)Cc1ccc(CNc2cccc(C(=O)c3cn(CCCC(=O)O)c4ccccc34)c2)cc1

nearest known ligand 0.79

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 6/20 0.79
SRD5A2 P31213 6/20 0.79
CNR1 P21554 3/20 0.50
CNR2 P34972 3/20 0.50
MAPT P10636 2/20 0.44
KMT2A Q03164 1/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CREBBP Q92793 1/20 0.42

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
SCHEMBL9334460 0.92 SRD5A1 (0.72) SRD5A1SRD5A2CNR1CNR2KMT2A
SCHEMBL9334540 0.92 SRD5A1 (0.70) SRD5A1SRD5A2CNR1CNR2MAPT
Hydrochloric Acid SCHEMBL9337443 0.92 SRD5A1 (0.70) SRD5A1SRD5A2CNR1CNR2KMT2A
SCHEMBL9441319 0.89 SRD5A1 (0.73) SRD5A1SRD5A2CNR1CNR2
SCHEMBL8793533 0.89 SRD5A1 (0.64) SRD5A1SRD5A2CNR1CNR2MAPT
SCHEMBL3504489 0.88 SRD5A1 (1.00) SRD5A1SRD5A2CNR1CNR2MAPT
SCHEMBL29633452 0.88 SRD5A1 (1.00) SRD5A1SRD5A2CNR1CNR2MAPT
SCHEMBL8793385 0.88 SRD5A1 (0.88) SRD5A1SRD5A2CNR1CNR2MAPT
Hydrochloric Acid SCHEMBL8793978 0.87 SRD5A1 (0.98) SRD5A1SRD5A2CNR1CNR2MAPT
SCHEMBL27314275 0.87 SRD5A1 (0.74) SRD5A1SRD5A2CNR1CNR2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5312829-A Testosterone 5alpha-reductase inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-17 US disclosed
US-5212320-A Enzyme inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-18 US disclosed
EP-0458207-A2 Indole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-11-27 EP disclosed