SCHEMBL21728463

SCHEMBL21728463

Cc1ccccc1/N=C\C=N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.52
LMNA P02545 6/20 0.51
HPGD P15428 2/20 0.51
MAPT P10636 6/20 0.43
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 3/20 0.43
RECQL P46063 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
POLB P06746 1/20 0.43
MPI P34949 1/20 0.43
HTT P42858 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
THRB P10828 1/20 0.43
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
PKM P14618 1/20 0.40
TSHR P16473 4/20 0.38

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
SCHEMBL239325 0.86 CYP2C9 (0.59) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL29472028 0.86 CYP2C9 (0.59) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL239326 0.86 CYP2C9 (0.59) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL16234584 0.80 CYP2C9 (0.53) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL7091919 0.78 CYP2C9 (0.52) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL12332461 0.78 CYP2C9 (0.52) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL19625972 0.77 LMNA (0.50) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL17591502 0.77 LMNA (0.50) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL14404845 0.77 LMNA (0.50) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL22539007 0.75 CYP2C9 (0.57) CYP2C9LMNAHPGDMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2270064-B1 Organic semiconductor polymer, transistor including an organic semiconductor polymer and methods of fabricating the same SAMSUNG ELECTRONICS CO LTD (KR) 2020-02-19 EP disclosed