SCHEMBL8599094

SCHEMBL8599094

CCN(CC)CCCOc1ccc(C(=O)c2c(-c3ccccc3)sc3cc(OC)ccc23)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 17/20 0.58
ESR2 Q92731 13/20 0.58
CNR1 P21554 1/20 0.54
CNR2 P34972 1/20 0.54
BCHE P06276 1/20 0.52
ACHE P22303 1/20 0.52
TUBB4A P04350 1/20 0.50
TUBB P07437 1/20 0.50
TUBA3C P0DPH7 1/20 0.50
TUBA1B P68363 1/20 0.50
TUBA4A P68366 1/20 0.50
TUBB4B P68371 1/20 0.50
TUBB3 Q13509 1/20 0.50
TUBB2A Q13885 1/20 0.50
TUBB8 Q3ZCM7 1/20 0.50
TUBA3E Q6PEY2 1/20 0.50
TUBA1A Q71U36 1/20 0.50
TUBA1C Q9BQE3 1/20 0.50
TUBB6 Q9BUF5 1/20 0.50
TUBB2B Q9BVA1 1/20 0.50

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
SCHEMBL8597235 0.95 ESR1 (0.58) ESR1ESR2CNR1CNR2TUBB4A
SCHEMBL8599193 0.90 ESR1 (0.64) ESR1ESR2CNR1ACHE
SCHEMBL11673921 0.90 ESR1 (0.62) ESR1ESR2CNR1CNR2BCHE
SCHEMBL11547774 0.90 ESR1 (0.64) ESR1ESR2CNR1CNR2TUBB4A
SCHEMBL11673824 0.89 CNR2 (0.71) ESR1ESR2CNR1CNR2BCHE
SCHEMBL11547336 0.88 ESR1 (0.61) ESR1ESR2CNR1CNR2TUBB4A
SCHEMBL8596134 0.87 ESR1 (0.60) ESR1ESR2CNR1CNR2TUBB4A
SCHEMBL7626623 0.85 ESR1 (0.65) ESR1ESR2CNR1ACHE
SCHEMBL8600465 0.85 ESR1 (0.62) ESR1ESR2CNR1CNR2TUBB4A
SCHEMBL11554799 0.85 ESR1 (0.60) ESR1ESR2CNR1CNR2TUBB4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0641791-B1 NOVEL BENZOTHIOPHENE DERIVATIVE TEIKOKU HORMONE MFG CO LTD (JP) 1998-01-28 EP disclosed
US-5556876-A ANTICHOLESTEROL AGENTS USING DERIVATIVES OF BENZOTHIENYL KETONES ELI LILLY AND COMPANY (US) 1996-09-17 US disclosed
US-5482950-A BENZOTHIOPHENE DERIVATIVE ELI LILLY AND COMPANY (US) 1996-01-09 US disclosed
US-5480904-A BENZOTHIOPHENE COMPOUND ELI LILLY AND COMPANY (US) 1996-01-02 US disclosed
US-5472962-A Antiestrogenic agents TEIKOKU HORMONE MFG. CO., LTD. (JP) 1995-12-05 US disclosed
US-5441964-A Especially post-memopausal women ELI LILLY AND COMPANY (US) 1995-08-15 US disclosed
EP-0657162-A1 Methods for lowering serum cholesterol ELI LILLY AND COMPANY (US) 1995-06-14 EP disclosed
EP-0651998-A1 Methods for inhibiting bone loss ELI LILLY AND COMPANY (US) 1995-05-10 EP disclosed
EP-0650724-A1 Methods for inhibiting uterine fibrosis ELI LILLY AND COMPANY (US) 1995-05-03 EP disclosed
EP-0641791-A1 NOVEL BENZOTHIOPHENE DERIVATIVE TEIKOKU HORMONE MFG. CO., LTD. (JP) 1995-03-08 EP disclosed