SCHEMBL9681352

SCHEMBL9681352

C1=Cc2nc1c(-c1c3ccccc3cc3ccccc13)c1ccc([nH]1)c(-c1c3ccccc3cc3ccccc13)c1nc(c(-c3c4ccccc4cc4ccccc34)c3ccc([nH]3)c2-c2c3ccccc3cc3ccccc23)C=C1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 2/20 0.42
▸ STAT3 P40763 1/20 0.42
▸ STAT1 P42224 1/20 0.42
▸ TOP1 P11387 2/20 0.41
▸ NISCH Q9Y2I1 1/20 0.41
▸ CYCS P99999 3/20 0.41
▸ ENPP2 Q13822 1/20 0.40

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
SCHEMBL18091353 0.98 TERT (0.41) TERTSTAT3STAT1TOP1NISCH
SCHEMBL18091350 0.83 STAT3 (0.54) TERTSTAT3STAT1TOP1NISCH
SCHEMBL30530582 0.81 TERT (0.41) TERTSTAT3STAT1TOP1CYCS
SCHEMBL10609096 0.80 TERT (0.39) TERTSTAT3STAT1TOP1CYCS
SCHEMBL8021991 0.80 PTPN22 (0.42) TERTTOP1CYCSENPP2
SCHEMBL31055466 0.77 GSK3B (0.46) TERTTOP1NISCHCYCS
SCHEMBL31055465 0.77 GSK3B (0.46) TERTTOP1NISCHCYCS
SCHEMBL4320743 0.77 GSK3B (0.46) TERTTOP1NISCHCYCS
SCHEMBL31055464 0.77 GSK3B (0.46) TERTTOP1NISCHCYCS
SCHEMBL11330218 0.76 WDR5 (0.64) TOP1CYCSENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3274420-A1 CAPSULE SUITABLE FOR NON-INVASIVE SIMULTANEOUS OXYGEN CONTENT AND TEMPERATURE SENSING IN A LIVING OBJECT Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2018-01-31 — — EP disclosed
WO-2016150677-A1 CAPSULE SUITABLE FOR NON-INVASIVE SIMULTANEOUS OXYGEN CONTENT AND TEMPERATURE SENSING IN A LIVING OBJECT MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2016-09-29 — — WO disclosed
US-5130493-A Oxidation of o-cresol in the presence of a chelate compound of iron and manganese with mesotetraarylporphine BAYER AKTIENGESELLSCHAFT (DE) 1992-07-14 — — US disclosed
Send feedback