SCHEMBL2011512

SCHEMBL2011512

c1ccc(C2=NOc3ccccc3C2c2ccccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.35
GAA P10253 4/20 0.35
KMT2A Q03164 3/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
GFER P55789 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP2C9 P11712 1/20 0.35
LMNA P02545 4/20 0.34
MEN1 O00255 2/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NISCH Q9Y2I1 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL6167985 0.78 MAPT (0.42) MAPTGAAKMT2AKDM4EALDH1A1
SCHEMBL8009756 0.73 KDM4E (0.42) MAPTGAAKMT2AKDM4EALDH1A1
SCHEMBL40368 0.71 CYP2C9 (0.55) MAPTGAAKMT2AALDH1A1HSD17B10
SCHEMBL7546321 0.69 CYP2C9 (0.34) MAPTGAAKMT2AALDH1A1HSD17B10
SCHEMBL4583348 0.68 LMNA (0.46) MAPTGAAKMT2AALDH1A1HSD17B10
SCHEMBL6241456 0.67 CYP2C9 (0.42) MAPTGAAKMT2AKDM4EALDH1A1
SCHEMBL25949524 0.67 CYP2C9 (0.42) MAPTKMT2AKDM4EALDH1A1HPGD
SCHEMBL12203849 0.66 TAAR1 (0.42) MAPTGAAKMT2AKDM4EALDH1A1
SCHEMBL10951188 0.65 HTR2A (0.33) CYP2C9NISCHMAOAMAOB
SCHEMBL27927654 0.65 CYP2C9 (0.49) MAPTGAAKMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3053963-A1 HALOGEN-FREE RESIN COMPOSITION AND USE THEREOF Shengyi Technology Co. Ltd. (CN) 2016-08-10 EP disclosed
US-20140072800-A1 COATED ARTICLE COMPRISING A CURABLE COMPOSITION COMPRISING BIS-BENZOXAZINE AND AN AMINO-FUNCTIONALIZED TRIAZINE E I DU PONT DE NEMOURS AND COMPANY (US) 2014-03-13 US disclosed
US-20140073736-A1 CURABLE COMPOSITION COMPRISING BIS-BENZOXAZINE, METHOD OF CURING, AND THE CURED COMPOSITION SO FORMED E I DU PONT NEMOURS AND COMPANY (US) 2014-03-13 US disclosed
US-20140069693-A1 MULTI-LAYER ARTICLE COMPRISING DISCRETE CONDUCTIVE PATHWAYS CONTACTING A CURABLE COMPOSITION COMPRISING BIS-BENZOXAZINE E I DU PONT DE NEMOURS AND COMPANY (US) 2014-03-13 US disclosed
US-20110152453-A1 Benzoxazine Compounds Derivated From Phenolphtalein Having Flame-Retardant Properties And A Process For Their Preparation HUNTSMAN ADVANCED MATERIALS AMERICAS INC. (US) 2011-06-23 US 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-20110152453-A1 Benzoxazine Compounds Derivated From Phenolphtalein Having Flame-Retardant Properties And A Process For Their Preparation HPD, PAH, BRPF3 MAPT 1000/4885GAA 3518/4885KMT2A 806/4885

“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.