SCHEMBL7937286

SCHEMBL7937286

CCOc1ccccc1N1CCN(CCCOc2cc(C(=O)c3cn(CCCC(=O)O)c4ccccc34)ccc2NCc2ccc(CC)cc2)CC1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 8/20 0.48
ADRA1A P35348 5/20 0.48
ADRA1B P35368 5/20 0.48
DRD2 P14416 1/20 0.43
HTR6 P50406 1/20 0.43

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
Hydrochloric Acid SCHEMBL7934777 0.95 ADRA1D (0.48) ADRA1DADRA1AADRA1BDRD2HTR6
SCHEMBL7933955 0.95 ADRA1D (0.48) ADRA1DADRA1AADRA1BDRD2HTR6
SCHEMBL7924486 0.95 ADRA1D (0.55) ADRA1DADRA1AADRA1BDRD2
Hydrochloric Acid SCHEMBL7931374 0.94 ADRA1D (0.55) ADRA1DADRA1AADRA1BDRD2
Hydrochloric Acid SCHEMBL7934761 0.93 ADRA1D (0.55) ADRA1DADRA1AADRA1BDRD2
Hydrochloric Acid SCHEMBL7937265 0.93 ADRA1D (0.46) ADRA1DADRA1AADRA1B
Hydrochloric Acid SCHEMBL7924541 0.92 ADRA1D (0.53) ADRA1DADRA1AADRA1B
Hydrochloric Acid SCHEMBL7931327 0.89 ADRA1D (0.53) ADRA1DADRA1AADRA1BDRD2
Hydrochloric Acid SCHEMBL7924505 0.89 ADRA1D (0.55) ADRA1DADRA1AADRA1B
Hydrochloric Acid SCHEMBL7924603 0.89 ADRA1D (0.46) ADRA1DADRA1AADRA1BDRD2

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