SCHEMBL3962970

SCHEMBL3962970

CC(=O)N(c1ccc(C(C)C)cc1)c1ccc(C(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
USP2 O75604 1/20 0.46
GAA P10253 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP2C9 P11712 2/20 0.42
CYP2D6 P10635 1/20 0.42
HIF1A Q16665 1/20 0.42
TYR P14679 2/20 0.42
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 1/20 0.41
S100A4 P26447 1/20 0.41
USP5 P45974 1/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
APAF1 O14727 1/20 0.40
TDP2 O95551 1/20 0.40
NSD2 O96028 1/20 0.40
CASP3 P42574 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
SCHEMBL7208178 0.94 KIF11 (0.47) ALDH1A1LMNASMN1; SMN2USP2GAA
SCHEMBL8556395 0.83 ALDH1A1 (0.46) ALDH1A1LMNASMN1; SMN2USP2GAA
SCHEMBL10080954 0.81 ALDH1A1 (0.69) ALDH1A1LMNASMN1; SMN2USP2GAA
SCHEMBL28763259 0.77 MT-CO2 (0.57) ALDH1A1LMNAGAAHSD17B10KDM4E
SCHEMBL22537737 0.76 OXTR (0.45) ALDH1A1LMNASMN1; SMN2USP2GAA
SCHEMBL978072 0.75 CYP2C9 (0.48) ALDH1A1LMNASMN1; SMN2USP2GAA
SCHEMBL7949240 0.75 NPSR1 (0.45) ALDH1A1LMNASMN1; SMN2GAACYP2C9
SCHEMBL8044893 0.75 NPSR1 (0.61) ALDH1A1LMNAS100A4HPGDMEN1
SCHEMBL7153902 0.75 ESR1 (0.47) ALDH1A1LMNAHSD17B10HIF1ATYR
SCHEMBL4633234 0.73 TSHR (0.56) S100A4MEN1KMT2AMT-CO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1624500-B1 Spiro bifluorene compounds as organic semiconductor matrix materials NOVALED GMBH (DE) 2016-03-16 EP disclosed
US-7540978-B2 Use of an organic matrix material for producing an organic semiconductor material, organic semiconductor material and electronic component NOVALED AG (DE) 2009-06-02 US disclosed
US-7540978-B2 Use of an organic matrix material for producing an organic semiconductor material, organic semiconductor material and electronic component NOVALED AG (DE) 2009-06-02 US disclosed
US-7540978-B2 Use of an organic matrix material for producing an organic semiconductor material, organic semiconductor material and electronic component NOVALED AG (DE) 2009-06-02 US disclosed
US-20060049397-A1 Use of an organic matrix material for producing an organic semiconductor material, organic semiconductor material and electronic component NOVALED AG (DE) 2006-03-09 US disclosed
EP-1624500-A1 Spiro bifluorene compounds as organic semiconductor matrix materials Novaled GmbH (DE) 2006-02-08 EP disclosed
EP-0935691-B1 OPTICAL BRIGHTENING AGENT COVION ORGANIC SEMICONDUCTORS (DE) 2004-05-26 EP disclosed
EP-0676461-B1 Spiro compounds and their application as electroluminescence materials COVION ORGANIC SEMICONDUCTORS (DE) 2002-08-14 EP disclosed
EP-0935691-A1 OPTICAL BRIGHTENING AGENT Aventis Research & Technologies GmbH & Co. KG (DE) 1999-08-18 EP disclosed
WO-1998018996-A1 OPTICAL BRIGHTENING AGENT AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO KG (DE) 1998-05-07 WO disclosed
EP-0676461-A2 Spiro compounds and their application as electroluminescence materials HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060049397-A1 Use of an organic matrix material for producing an organic semiconductor material, organic semiconductor material and electronic component ILK, SOST, VIM ALDH1A1 3436/4885LMNA 1601/4885SMN1; SMN2 1612/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.