SCHEMBL6136057

SCHEMBL6136057

CN(CCc1cccc(Cc2c(-c3ccc(O)cc3)ccc3cc(O)ccc23)c1)C(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 1/20 0.40
▸ TRPV1 Q8NER1 3/20 0.37
▸ CNR1 P21554 5/20 0.37
▸ ROCK2 O75116 1/20 0.37
▸ ROCK1 Q13464 1/20 0.37
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ TOP2A P11388 1/20 0.36
▸ TOP2B Q02880 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ ESR1 P03372 3/20 0.36
▸ ESR2 Q92731 3/20 0.36
▸ MTOR P42345 1/20 0.36
▸ AOC3 Q16853 2/20 0.35

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
SCHEMBL6136383 0.96 NPY5R (0.43) NPY5RTRPV1ROCK2ROCK1CA12
SCHEMBL6136266 0.92 MTOR (0.44) NPY5RTRPV1ROCK2ROCK1CA12
SCHEMBL6135989 0.90 GAA (0.40) TRPV1CNR1ROCK2TOP2ATOP2B
SCHEMBL6136417 0.90 NPY5R (0.45) NPY5RROCK2ROCK1CA12CA1
SCHEMBL6135968 0.85 TRPV1 (0.41) TRPV1ROCK2ROCK1TOP2ATOP2B
SCHEMBL6136478 0.85 MTOR (0.48) TRPV1ROCK2TSHRESR1ESR2
SCHEMBL6136184 0.83 CNR1 (0.54) TRPV1CNR1
SCHEMBL6136150 0.81 CNR1 (0.39) TRPV1CNR1ESR1ESR2
SCHEMBL6136274 0.80 ROCK2 (0.41) TRPV1ROCK2ROCK1TOP2ATOP2B
SCHEMBL6136341 0.80 MTOR (0.53) TRPV1ROCK2ROCK1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0895989-B1 1-[4-(Substituted alkoxy)benzyl] naphthalene compounds having estrogen inhibitory activity LILLY CO ELI (US) 2005-05-18 — — EP claimed
US-6509356-B1 Estrogen inhibitory activity method for the treatment of breast cancer in a woman comprising administering to a patient a therapeutically effective amount of a compound ELI LILLY AND COMPANY 2003-01-21 — — US claimed
EP-0895989-A1 1-[4-(Substituted alkoxy)benzyl] naphthalene compounds having estrogen inhibitory activity ELI LILLY AND COMPANY (US) 1999-02-10 — — EP claimed
EP-0895989-B1 1-[4-(Substituted alkoxy)benzyl] naphthalene compounds having estrogen inhibitory activity LILLY CO ELI (US) 2005-05-18 — — EP disclosed
US-6509356-B1 Estrogen inhibitory activity method for the treatment of breast cancer in a woman comprising administering to a patient a therapeutically effective amount of a compound ELI LILLY AND COMPANY 2003-01-21 — — US disclosed
WO-1999007377-A1 1-[4-(SUBSTITUTED ALKOXY)BENZYL]NAPHTHALENE COMPOUNDS HAVING ESTROGEN INHIBITORY ACTIVITY ELI LILLY AND COMPANY (US) 1999-02-18 — — WO disclosed
EP-0895989-A1 1-[4-(Substituted alkoxy)benzyl] naphthalene compounds having estrogen inhibitory activity ELI LILLY AND COMPANY (US) 1999-02-10 — — EP disclosed
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