SCHEMBL14427134

SCHEMBL14427134

CC(C)(C)c1ccc2cc3ccc(C(C)(C)C)cc3nc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 3/20 0.46
▸ APP P05067 1/20 0.46
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ KCNH2 Q12809 2/20 0.44
▸ ACHE P22303 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ HRH3 Q9Y5N1 2/20 0.44
▸ F2 P00734 1/20 0.44
▸ CHRM2 P08172 1/20 0.44
▸ HTR1A P08908 1/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ MAOA P21397 1/20 0.44
▸ DRD1 P21728 1/20 0.44
▸ PTGS1 P23219 1/20 0.44
▸ SLC6A2 P23975 1/20 0.44
▸ SLC6A4 P31645 1/20 0.44
▸ OPRM1 P35372 1/20 0.44
▸ DRD3 P35462 1/20 0.44

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
SCHEMBL14439551 0.85 TERT (0.41) TERTAPPMEN1KMT2AKCNH2
SCHEMBL21105269 0.84 TRPV1 (0.38) TERTAPPMEN1KMT2AKCNH2
SCHEMBL23118240 0.83 SCN10A (0.47) MEN1KMT2AKCNH2LMNAALDH1A1
SCHEMBL2707266 0.83 SCN10A (0.47) MEN1KMT2AKCNH2LMNAALDH1A1
SCHEMBL12025134 0.80 CYP1A2 (0.57) MEN1KMT2ALMNARAB9AKDM4E
SCHEMBL2707037 0.80 TSHR (0.39) MEN1KMT2AKCNH2HRH3HTT
SCHEMBL22521433 0.80 KMT2A (0.39) MEN1KMT2AKCNH2HRH3ALDH1A1
SCHEMBL22521368 0.79 BACE1 (0.52) MEN1KMT2AKCNH2HRH3ALDH1A1
SCHEMBL1695518 0.79 TRPV1 (0.40) MEN1KMT2AKCNH2HRH3ALDH1A1
SCHEMBL28334187 0.78 PDE3B (0.40) MEN1KMT2AKCNH2ACHEHRH3

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
US-20070197699-A1 Novel substituted-polyaryl chromophoric compounds TRANSPHOTONICS, LLC (US) 2007-08-23 — — US disclosed
US-7205347-B2 Substituted-polyaryl chromophoric compounds TRANS PHOTONICS, LLC. (US) 2007-04-17 — — US disclosed
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