SCHEMBL2491365

SCHEMBL2491365

Cc1nnc2[nH]nc(N=Cc3ccccc3)c2c1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
CTH P32929 1/20 0.35
ALDH1A1 P00352 3/20 0.33
LMNA P02545 3/20 0.33
RAB9A P51151 2/20 0.33
FFAR1 O14842 1/20 0.32
G6PD P11413 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CDK4 P11802 1/20 0.31
CDK6 Q00534 1/20 0.31
POLB P06746 1/20 0.31
PKM P14618 2/20 0.31
MITF O75030 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
MDM2 Q00987 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
SCHEMBL3462734 1.00 HPGD (0.36) HPGDSMN1; SMN2KMT2AMEN1CTH
SCHEMBL19951219 0.65 CHEK1 (0.44) HPGDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL7255702 0.64 ALPL (0.38) HPGDSMN1; SMN2KMT2AMEN1CTH
SCHEMBL7126825 0.63 GSK3B (0.48)
SCHEMBL7126823 0.63 GSK3B (0.48)
SCHEMBL29768210 0.61 GAA (0.37) HPGDSMN1; SMN2KMT2AMEN1CTH
SCHEMBL11410003 0.57 ALDH1A1 (0.49) HPGDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL9804987 0.57 ALDH1A1 (0.55) HPGDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL11410006 0.57 ALDH1A1 (0.49) HPGDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL29273907 0.56 GRM4 (0.55) HPGDSMN1; SMN2KMT2AMEN1ALDH1A1

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