SCHEMBL12190732

SCHEMBL12190732

CCCCCCOc1ccc(-c2c3nc(c(-c4ccc(OCCCCCC)cc4)c4ccc([nH]4)c(-c4ccc(OCCCCCC)cc4)c4nc(c(-c5ccc(OCCCCCC)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 2/20 0.49
▸ TOP1 P11387 2/20 0.46
▸ NR5A1 Q13285 1/20 0.45
▸ RARB P10826 3/20 0.45
▸ CYCS P99999 2/20 0.45
▸ CYP3A4 P08684 3/20 0.44
▸ CYP2D6 P10635 3/20 0.44
▸ ABCG2 Q9UNQ0 1/20 0.44
▸ HPGD P15428 4/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ ENPP2 Q13822 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ CYP1A2 P05177 2/20 0.43
▸ CYP19A1 P11511 2/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ ALDH1A1 P00352 3/20 0.43

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
SCHEMBL8031578 1.00 TERT (0.49) TERTTOP1NR5A1RARBCYCS
SCHEMBL2531376 1.00 TERT (0.49) TERTTOP1NR5A1RARBCYCS
SCHEMBL12633085 0.95 TERT (0.47) TERTTOP1NR5A1RARBCYCS
SCHEMBL588821 0.94 TERT (0.44) TERTTOP1NR5A1RARBCYCS
SCHEMBL584873 0.94 NR5A1 (0.57) TERTTOP1NR5A1RARBCYCS
SCHEMBL586280 0.94 NR5A1 (0.57) TERTTOP1NR5A1RARBCYCS
SCHEMBL585100 0.94 NR5A1 (0.57) TERTTOP1NR5A1RARBCYCS
SCHEMBL584872 0.94 NR5A1 (0.57) TERTTOP1NR5A1RARBCYCS
SCHEMBL585897 0.94 NR5A1 (0.57) TERTTOP1NR5A1RARBCYCS
SCHEMBL585218 0.94 TERT (0.44) TERTTOP1NR5A1RARBCYCS

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-8030422-B2 Recoverable polymer-bound homogeneous catalysts for catalytic chain transfer process E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-10-04 — — US disclosed
US-20100261851-A1 Recoverable polymer-bound homogeneous catalysts for catalytic chain transfer process AXALTA COATING SYSTEMS IP CO. LLC (FORMERLY KNOWN AS U.S. COATINGS IP CO. LLC) 2010-10-14 — — US disclosed
Send feedback