SCHEMBL7795926

SCHEMBL7795926

CCCOc1cc(OC)c2c(c1N)C(=O)c1cccc(OCCN3CCCC3)c1-2

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
HTR2C P28335 11/20 0.46
HTR2B P41595 4/20 0.43
HTR2A P28223 3/20 0.43
MCHR1 Q99705 1/20 0.42

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 SCHEMBL7792164 0.99 POLB (0.46) POLBHTR2CHTR2BHTR2AMCHR1
SCHEMBL7796231 0.96 TDP1 (0.43) POLBHTR2C
SCHEMBL7795958 0.96 TDP1 (0.43) POLBHTR2C
SCHEMBL7795771 0.96 POLB (0.51) POLBHTR2CHTR2BHTR2AMCHR1
SCHEMBL7796350 0.95 HTR2C (0.51) POLBHTR2CHTR2BHTR2A
SCHEMBL7796218 0.95 HTR2C (0.44) POLBHTR2CHTR2BHTR2A
SCHEMBL7795913 0.94 POLB (0.47) POLBHTR2CHTR2BHTR2AMCHR1
SCHEMBL7792689 0.94 POLB (0.51) POLBHTR2CHTR2BHTR2AMCHR1
SCHEMBL7796421 0.93 ALDH1A1 (0.45) POLBHTR2C
SCHEMBL7792226 0.93 ALDH1A1 (0.45) POLBHTR2C

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
EP-0906268-B1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS AVENTIS PHARMA INC (US) 2001-11-28 EP disclosed
US-6004959-A HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed