SCHEMBL2491044

SCHEMBL2491044

C(=Cc1cnnc2ccccc12)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 3/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
CASP3 P42574 1/20 0.44
HTT P42858 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
KDM4E B2RXH2 3/20 0.43
RAB9A P51151 4/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PDGFRB P09619 1/20 0.42
PDGFRA P16234 1/20 0.42
ELANE P08246 1/20 0.41
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41

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
SCHEMBL2491042 1.00 MAPT (0.44) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL9111565 0.77 GPR3 (0.39) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL9114832 0.76 GPR3 (0.44) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL2009244 0.76 GPR3 (0.44) MEN1KMT2ALMNAALDH1A1HTT
SCHEMBL13134221 0.76 GPR3 (0.44) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL11215153 0.74 CHAT (0.55) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL11259417 0.74 CHAT (0.55) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL3174845 0.73 ALDH1A1 (0.76) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL3174841 0.73 ALDH1A1 (0.76) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL10738301 0.71 HPGD (0.42) MAPTMEN1KMT2ALMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8330039-B2 Solar cell modules with poly(vinyl butyral) encapsulant comprising unsaturated heterocyclic compound E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-11 US disclosed
EP-2380208-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. du Pont de Nemours and Company (US) 2011-10-26 EP disclosed
WO-2010085664-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-29 WO disclosed
US-20100180947-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-22 US disclosed