SCHEMBL5344967

SCHEMBL5344967

Cc1cccc(C)c1-c1cccc2c1C=CC2

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.37
HTR1A P08908 2/20 0.35
DRD2 P14416 2/20 0.35
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
HTR7 P34969 1/20 0.33
HRH4 Q9H3N8 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HTR5A P47898 1/20 0.31
DPP4 P27487 1/20 0.30
PDK2 Q15119 1/20 0.30

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
SCHEMBL6649235 0.92 MYC (0.33) MYCHTR1ADRD2
SCHEMBL5344329 0.85 HTR7 (0.38) HTR1ACA1CA2HTR7MEN1
SCHEMBL29767630 0.85 HTR7 (0.38) HTR1ACA1CA2HTR7MEN1
SCHEMBL5347164 0.84 PRKCQ (0.30)
SCHEMBL5344283 0.84 CNR2 (0.33) MEN1KMT2A
SCHEMBL28424456 0.84 HTR7 (0.37) HTR1ACA1CA2HTR7MEN1
SCHEMBL319418 0.82 CYP2A6 (0.35) CA1CA2CA7CA9HTR5A
SCHEMBL9319419 0.81 CYP1A2 (0.39) HTR1AHTR7MEN1KMT2A
SCHEMBL6454972 0.80 CA1 (0.35) CA1CA2CA7CA9HTR5A
SCHEMBL2238234 0.79 HEXA (0.36) MYCCA1CA2CA9PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7297747-B2 Polymerization process and polymer composition EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-11-20 US disclosed
WO-2007109783-A2 SUBSTITUTED PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-09-27 WO disclosed
US-7122498-B2 Metallocenes and catalyst compositions derived therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-10-17 US disclosed
US-6870016-B1 Polymerization process and polymer composition EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-03-22 US disclosed
US-20050059785-A1 Polymerization process and polymer composition HART JAMES R (US) 2005-03-17 US disclosed
US-20050054520-A1 Metallocenes and catalyst compositions derived therefrom EXXONMOBIL CHEMICAL PATENT INC. 2005-03-10 US disclosed
EP-1421090-A2 METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM Exxonmobil Chemical Patents Inc. (US) 2004-05-26 EP disclosed
WO-2003002583-A2 METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-01-09 WO disclosed