SCHEMBL7931370

SCHEMBL7931370

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

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.51
CREBBP Q92793 1/20 0.44
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CNR2 P34972 4/20 0.41
SRD5A1 P18405 2/20 0.40
SRD5A2 P31213 2/20 0.40

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
SCHEMBL7933951 0.88 CNR1 (0.54) CNR1CREBBPPOLBL3MBTL1CNR2
Hydrochloric Acid SCHEMBL7933289 0.85 ADRA1D (0.45) CNR1POLB
SCHEMBL7924583 0.83 CNR1 (0.58) CNR1CREBBPPOLBL3MBTL1CNR2
SCHEMBL7860934 0.82 CNR1 (0.53) CNR1CREBBPPOLBL3MBTL1CNR2
SCHEMBL7937279 0.80 ADRA1D (0.46) SRD5A1SRD5A2
SCHEMBL7924491 0.78 ADRA1D (0.53)
SCHEMBL7931372 0.78 CNR1 (0.53) CNR1CREBBPCNR2
Hydrochloric Acid SCHEMBL7931378 0.78 ADRA1D (0.52)
Hydrochloric Acid SCHEMBL7934780 0.78 ADRA1D (0.46) SRD5A1SRD5A2
Hydrochloric Acid SCHEMBL7924544 0.78 ADRA1D (0.51)

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