SCHEMBL30775462

SCHEMBL30775462

Nc1ccc(OC(=O)C=Cc2cccc(C=CC(=O)Oc3ccc(N)cc3)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.55
NPSR1 Q6W5P4 1/20 0.51
MEN1 O00255 3/20 0.51
KDM4E B2RXH2 2/20 0.51
GAA P10253 1/20 0.51
CYP3A4 P08684 1/20 0.47
CYP1B1 Q16678 1/20 0.46
HTR1A P08908 1/20 0.46
MAOB P27338 3/20 0.45
MAOA P21397 2/20 0.45
CYP19A1 P11511 3/20 0.45
PKM P14618 1/20 0.44
MAPT P10636 1/20 0.44
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPC1 O15118 1/20 0.43
POLB P06746 1/20 0.43
BLM P54132 1/20 0.43
MCL1 Q07820 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL15363574 1.00 KMT2A (0.55) KMT2ANPSR1MEN1KDM4EGAA
SCHEMBL15364398 0.94 NPSR1 (0.61) KMT2ANPSR1MEN1KDM4EGAA
SCHEMBL15364342 0.91 KMT2A (0.57) KMT2ANPSR1MEN1KDM4EGAA
SCHEMBL27758580 0.90 MAOB (0.58) KMT2ANPSR1MEN1KDM4EGAA
SCHEMBL27758521 0.90 MAOB (0.58) KMT2ANPSR1MEN1KDM4EGAA
SCHEMBL5089442 0.88 KMT2A (0.71) KMT2AMEN1KDM4ECYP1B1HTR1A
SCHEMBL15364313 0.86 KMT2A (0.62) KMT2AMEN1KDM4ECYP1B1CYP19A1
SCHEMBL15363576 0.86 KMT2A (0.62) KMT2AMEN1KDM4ECYP1B1CYP19A1
SCHEMBL15364341 0.86 KMT2A (0.62) KMT2AMEN1KDM4ECYP1B1CYP19A1
SCHEMBL15364345 0.86 KMT2A (0.62) KMT2AMEN1KDM4ECYP1B1CYP19A1

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
CN-117348297-A Method for producing liquid crystal alignment film, method for producing liquid crystal display element, liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2024-01-05 CN disclosed