SCHEMBL5249391

SCHEMBL5249391

C1CC2=C(C[N]1)CNN2

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL19068500 0.64
SCHEMBL4947130 0.62
SCHEMBL19629434 0.57
SCHEMBL18323892 0.57
SCHEMBL2498167 0.53 OR51E2 (0.31)
SCHEMBL9875700 0.47
SCHEMBL9856988 0.45
SCHEMBL22296920 0.45
SCHEMBL14375260 0.37
SCHEMBL8493529 0.30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210378964-A1 ORALLY DISINTEGRATING DOSAGE FORM FOR ADMINISTRATION OF AVANAFIL, AND ASSOCIATED METHODS OF MANUFACTURE AND USE VIVUS LLC 2021-12-09 US disclosed
US-20200030239-A1 ORALLY DISINTEGRATING DOSAGE FORM FOR ADMINISTRATION OF AVANAFIL, AND ASSOCIATED METHODS OF MANUFACTURE AND USE VIVUS LLC (F/K/A VIVUS, INC.) 2020-01-30 US disclosed
US-20190133955-A1 ORALLY DISINTEGRATING DOSAGE FORM FOR ADMINISTRATION OF AVANAFIL, AND ASSOCIATED METHODS OF MANUFACTURE AND USE VIVUS, INC. 2019-05-09 US disclosed
US-10028916-B2 Orally disintegrating dosage form for administration of avanafil, and associated methods of manufacture and use VIVUS, INC. (US) 2018-07-24 US disclosed
US-20160331687-A1 ORALLY DISINTEGRATING DOSAGE FORM FOR ADMINISTRATION OF AVANAFIL, AND ASSOCIATED METHODS OF MANUFACTURE AND USE VIVUS LLC (F/K/A VIVUS, INC.) 2016-11-17 US disclosed
EP-1219609-B1 AROMATIC NITROGENOUS SIX-MEMBERED RING COMPOUNDS TANABE SEIYAKU CO (JP) 2007-04-04 EP disclosed
US-6797709-B2 SEXUAL DISORDERS TANABE SEIYAKU CO., LTD. (JP) 2004-09-28 US disclosed
US-20030229095-A1 Sexual disorders TANABE SEIYAKU CO., LTD. 2003-12-11 US disclosed
US-6656935-B2 Treatment of penile erectile dysfunction, pulmonary hypertension, and diabetic gastroparesis TANABE SEIYAKU CO., LTD. (JP) 2003-12-02 US disclosed
US-20030032647-A1 Treatment of penile erectile dysfunction, pulmonary hypertension, and diabetic gastroparesis MITSUBISHI TANABE PHARMA CORPORATION (JP) 2003-02-13 US disclosed
EP-1219609-A1 AROMATIC NITROGENOUS SIX-MEMBERED RING COMPOUNDS TANABE SEIYAKU CO., LTD. (JP) 2002-07-03 EP disclosed