SCHEMBL7480673

SCHEMBL7480673

Fc1ccc(CCN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 20/20 1.00
HTR1B P28222 20/20 1.00
HTR2A P28223 1/20 0.81
HTR2C P28335 1/20 0.81
HTR1F P30939 1/20 0.81

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
SCHEMBL7474899 0.94 HTR1D (0.88) HTR1DHTR1BHTR2AHTR2CHTR1F
SCHEMBL7476371 0.93 HTR1D (1.00) HTR1DHTR1BHTR2AHTR2CHTR1F
SCHEMBL7474326 0.92 HTR1D (1.00) HTR1DHTR1BHTR2AHTR2CHTR1F
SCHEMBL7481042 0.90 HTR1D (1.00) HTR1DHTR1BHTR2AHTR2CHTR1F
SCHEMBL7478079 0.90 HTR1D (0.82) HTR1DHTR1BHTR2AHTR2CHTR1F
SCHEMBL7479048 0.90 HTR1D (1.00) HTR1DHTR1BHTR2AHTR2CHTR1F
SCHEMBL7477108 0.89 HTR1D (1.00) HTR1DHTR1BHTR2AHTR2CHTR1F
SCHEMBL7475873 0.88 HTR1D (0.81) HTR1DHTR1BHTR2AHTR2CHTR1F
SCHEMBL8111059 0.88 HTR1D (1.00) HTR1DHTR1BHTR2AHTR2CHTR1F
SCHEMBL7479637 0.87 HTR1D (0.88) HTR1DHTR1BHTR2AHTR2CHTR1F

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0925302-B1 PALLADIUM CATALYZED INDOLIZATION MERCK & CO INC (US) 2002-11-20 EP claimed
EP-0844996-A1 SUBSTITUTED 1-INDOLYLPROPYL-4-PHENETHYLPIPERAZINE DERIVATIVES MERCK SHARP & DOHME LTD. (GB) 1998-06-03 EP claimed
WO-1997006159-A1 SUBSTITUTED 1-INDOLYLPROPYL-4-PHENETHYLPIPERAZINE DERIVATIVES MERCK SHARP & DOHME LIMITED (GB) 1997-02-20 WO claimed
EP-0925302-B1 PALLADIUM CATALYZED INDOLIZATION MERCK & CO INC (US) 2002-11-20 EP disclosed
US-5889008-A Substituted 1-indolylpropyl-4-phenethylpiperazadine derivatives MERCK SHARP & DOHME, LTD. (GB) 1999-03-30 US disclosed