SCHEMBL7933951

SCHEMBL7933951

CCOC(=O)CCCn1cc(C(=O)c2ccc(N(C)c3ccc(CC)cc3)c(O)c2)c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.54
CREBBP Q92793 1/20 0.47
POLB P06746 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SRD5A1 P18405 5/20 0.45
SRD5A2 P31213 5/20 0.45
CNR2 P34972 6/20 0.43
LMNA P02545 1/20 0.43
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL7931370 0.88 CNR1 (0.51) CNR1CREBBPPOLBL3MBTL1SRD5A1
SCHEMBL27537255 0.87 SRD5A1 (0.49) CNR1CREBBPSRD5A1SRD5A2CNR2
SCHEMBL7861333 0.83 CNR1 (0.67) CNR1CREBBPPOLBL3MBTL1SRD5A1
SCHEMBL7933927 0.83 CNR1 (0.55) CNR1CREBBPPOLBL3MBTL1SRD5A1
SCHEMBL7934794 0.81 CNR1 (0.63) CNR1CREBBPPOLBL3MBTL1SRD5A1
Hydrochloric Acid SCHEMBL7933289 0.80 ADRA1D (0.45) CNR1POLBALDH1A1TSHR
SCHEMBL7859329 0.79 CNR1 (0.56) CNR1CREBBPPOLBL3MBTL1SRD5A1
SCHEMBL7853735 0.79 CNR1 (0.70) CNR1CREBBPPOLBL3MBTL1SRD5A1
SCHEMBL8793547 0.78 CNR1 (0.73) CNR1CREBBPPOLBL3MBTL1CNR2
SCHEMBL27304797 0.76 CNR1 (0.70) CNR1CREBBPPOLBL3MBTL1SRD5A1

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
US-6242449-B1 TREATING PROSTATIC HYPERTROPHY, URINATION DISORDERS ASSOCIATED WITH PROSTATIC HYPERTROPHY, MALE PATTERN ALOPECIA, OR ACNE ZERIA PHARMACEUTICAL CO., LTD. (JP) 2001-06-05 US disclosed
EP-0997457-A1 3-BENZOYLINDOLE DERIVATIVES AND DRUGS CONTAINING THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 2000-05-03 EP disclosed