SCHEMBL9033276

SCHEMBL9033276

Cc1cc(N)ccc1/C=C/c1ccc(N)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
PDE10A Q9Y233 1/20 0.50
CASP1 P29466 4/20 0.48
CYP3A4 P08684 2/20 0.44
TSHR P16473 2/20 0.44
KDM4E B2RXH2 4/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
MAPT P10636 4/20 0.43
LMNA P02545 3/20 0.43
THRB P10828 2/20 0.43
ALOX15 P16050 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.43
CASP6 P55212 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.41
GAA P10253 2/20 0.39
NR4A1 P22736 1/20 0.39
PTK2B Q14289 1/20 0.39
NPC1 O15118 2/20 0.39

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
SCHEMBL28304117 1.00 ALDH1A1 (0.56) ALDH1A1PDE10ACASP1CYP3A4TSHR
SCHEMBL16900545 0.91 CYP19A1 (0.49) ALDH1A1PDE10ACASP1MEN1KMT2A
SCHEMBL9294673 0.89 CYP19A1 (0.52) ALDH1A1PDE10AMEN1KMT2AMAPT
SCHEMBL13763238 0.89 ALDH1A1 (0.50) ALDH1A1PDE10ACASP1CYP3A4TSHR
SCHEMBL28496142 0.89 ALDH1A1 (0.50) ALDH1A1PDE10ACASP1CYP3A4TSHR
SCHEMBL12810945 0.89 ALDH1A1 (0.50) ALDH1A1PDE10ACASP1CYP3A4TSHR
SCHEMBL14159487 0.86 ALDH1A1 (0.43) ALDH1A1PDE10ACASP1CYP3A4TSHR
SCHEMBL27856085 0.86 CYP19A1 (0.55) ALDH1A1KDM4EMAPTL3MBTL1POLB
SCHEMBL23863464 0.83 ALDH1A1 (0.45) ALDH1A1PDE10ACASP1CYP3A4TSHR
SCHEMBL7258077 0.83 ALDH1A1 (0.45) ALDH1A1PDE10ACASP1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7812156-B2 Optical brightening agents CLARIANT FINANCE (BVI) LIMITED (VG) 2010-10-12 US disclosed
US-20070287842-A1 Conjugated Thiophenes Having Conducting Properties and Synthesis of Same UNIVERSITE DE MONTREAL (CA) 2007-12-13 US disclosed
US-20070245503-A1 Improvements Relating to Optical Brightening Agents ARCHROMA IP GMBH (CH) 2007-10-25 US disclosed
US-20070186358-A1 Concentrated optical brightener solutions CLARIANT FINANCE (BVI) LIMITED (VG) 2007-08-16 US disclosed
EP-0708796-A1 PROCESS FOR PREPARING COMPOSITES BASED ON ORIENTED MESOGENIC THERMOSET RESINS THE DOW CHEMICAL COMPANY (US) 1996-05-01 EP disclosed
EP-0573573-A1 MESOGENIC GLYCIDYL AMINES THE DOW CHEMICAL COMPANY (US) 1993-12-15 EP disclosed
WO-1992015630-A2 MESOGENIC GLYCIDYL AMINES THE DOW CHEMICAL COMPANY (US) 1992-09-17 WO 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 (2 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-20070287842-A1 Conjugated Thiophenes Having Conducting Properties and Synthesis of Same DDT, DDC, TRPA1 ALDH1A1 91/4885PDE10A 4541/4885CASP1 3804/4885
US-20070245503-A1 Improvements Relating to Optical Brightening Agents TYR, MAP1LC3B, MAP1LC3A ALDH1A1 1653/4885PDE10A 2174/4885CASP1 1965/4885

“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.