SCHEMBL11292597

SCHEMBL11292597

CC1CC(c2ccccc2Cl)c2cccc(Cl)c21

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.46
HTR2A P28223 5/20 0.46
HTR2B P41595 5/20 0.46
HRH3 Q9Y5N1 4/20 0.46
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
TP53 P04637 1/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL11295986 0.83 HTR2A (0.50) HTR2CHTR2AHTR2BHRH3TP53
SCHEMBL11773144 0.72 HTR2A (0.51) HTR2CHTR2AHTR2BHRH3
SCHEMBL11298536 0.71 HTR2C (0.45) HTR2CHTR2AHTR2BHRH3MEN1
SCHEMBL27633029 0.69 HTR2A (0.47) HTR2CHTR2AHTR2BHRH3TP53
SCHEMBL28284899 0.69 SLC6A2 (0.41)
SCHEMBL11296831 0.69 HTR2A (0.46) HTR2CHTR2AHTR2BHRH3
SCHEMBL17066443 0.69 HTR2A (0.38) HTR2CHTR2AHTR2BHRH3MEN1
SCHEMBL12875639 0.69 HTR2A (0.53) HTR2CHTR2AHTR2BHRH3LMNA
SCHEMBL31172498 0.69 HTR2A (0.53) HTR2CHTR2AHTR2BHRH3LMNA
SCHEMBL18611526 0.69 HTR2A (0.53) HTR2CHTR2AHTR2BHRH3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0004591-B1 SHELL CATALYST, PROCESS FOR ITS PREPARATION AND ITS USE FOR THE PREPARATION OF ANTHRAQUINONES BASF Aktiengesellschaft (DE) 1982-03-31 EP disclosed
US-4255285-A FOR THE CATALYTIC OXIDATION OF A 1-PHENYLINDAN TO AN ANTHRAQUINONE; ATOMIZING AN AQUEOUS VANADIUM COMPOUND TO COAT AND ROAST MOVING CARRIER PARTICLES BASF AKTIENGESELLSCHAFT (DE) 1981-03-10 US disclosed
EP-0004591-A1 Shell catalyst, process for its preparation and its use for the preparation of anthraquinones BASF Aktiengesellschaft (DE) 1979-10-17 EP disclosed
US-3998894-A DIMERIZATION AND CYCLIZATION OF A STYRENE AND A HAL GENO-STYRENE BASF AKTIENGESELLSCHAFT (DT) 1976-12-21 US disclosed