SCHEMBL9426481

SCHEMBL9426481

C=CCNC(=O)c1ccc2cc(C(=O)NCC=C)ccc2c1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.63
HPGD P15428 8/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
ALDH1A1 P00352 3/20 0.60
LMNA P02545 2/20 0.60
RAB9A P51151 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
CYP1A2 P05177 3/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2C19 P33261 2/20 0.57
KDM4E B2RXH2 1/20 0.57
GAA P10253 1/20 0.57
CYP2C9 P11712 1/20 0.57
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.48
HTT P42858 1/20 0.48

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
SCHEMBL2385213 0.86 HPGD (0.76) PKMHPGDMEN1KMT2AALDH1A1
SCHEMBL7110355 0.83 HPGD (0.67) PKMHPGDMEN1KMT2AALDH1A1
SCHEMBL7112031 0.82 RAB9A (0.75) PKMHPGDMEN1KMT2AALDH1A1
SCHEMBL5884635 0.79 HPGD (0.67) PKMHPGDMEN1KMT2AALDH1A1
SCHEMBL24227389 0.78 RAB9A (0.69) PKMHPGDMEN1KMT2AALDH1A1
SCHEMBL17426924 0.78 HPGD (0.65) PKMHPGDMEN1KMT2AALDH1A1
SCHEMBL17426921 0.78 HPGD (0.65) PKMHPGDMEN1KMT2AALDH1A1
SCHEMBL13397394 0.78 HPGD (0.65) PKMHPGDMEN1KMT2AALDH1A1
SCHEMBL9068167 0.78 PKM (0.68) PKMHPGDMEN1KMT2AALDH1A1
SCHEMBL7105506 0.78 HPGD (0.65) PKMHPGDMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6263701-A None JP disclosed
JP-H06263701-A N,N'-DIALLYL-2,6-NAPHTHALENE-DICARBOXAMIDE AND POLYMER USING THE SAME GENERAL SEKIYU KK 1994-09-20 JP disclosed