SCHEMBL18381144

SCHEMBL18381144

C/C=C\C(=Cc1ccccc1)Nc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ MAPT P10636 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ MAOB P27338 3/20 0.44
▸ MMP1 P03956 3/20 0.44
▸ MMP2 P08253 3/20 0.44
▸ MMP9 P14780 3/20 0.44
▸ EGFR P00533 2/20 0.44
▸ MAOA P21397 1/20 0.44
▸ TSHR P16473 2/20 0.41
▸ RAB9A P51151 4/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ NPC1 O15118 3/20 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
SCHEMBL18473251 0.84 GAA (0.45) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL14725059 0.81 ALDH1A1 (0.44) ALDH1A1KMT2AMEN1LMNATSHR
SCHEMBL24450112 0.78 TAS2R38 (0.39) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL13514968 0.78 TAS2R38 (0.39) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL21594553 0.78 MAPT (0.52) ALDH1A1KMT2AMAPTMEN1HPGD
SCHEMBL27657881 0.77 TGM2 (0.52) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL12344947 0.76 TGM2 (0.43) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL25839247 0.76 KMT2A (0.39) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL23664807 0.75 TGM2 (0.38) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL20690708 0.74 MAPT (0.38) ALDH1A1KMT2AMAPTMEN1KDM4E

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-2117062-B1 COMPOSITION FOR ORGANIC DEVICE, POLYMER MEMBRANE AND ORGANIC ELECTROLUMINESCENT DEVICE MITSUBISHI CHEM CORP (JP) 2017-01-18 — — EP disclosed
Send feedback