SCHEMBL7723638

SCHEMBL7723638

COc1ccc(-c2cc(NC(C)=O)c(=O)n(CC=Cc3ccc(Cl)cc3)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
MAPT P10636 4/20 0.42
MEN1 O00255 4/20 0.42
CYP2D6 P10635 2/20 0.42
MAPK1 P28482 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
LMNA P02545 4/20 0.42
TP53 P04637 2/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 1/20 0.42
PKM P14618 1/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
CYP2C19 P33261 1/20 0.42
THPO P40225 1/20 0.42
NPC1 O15118 1/20 0.42
GMNN O75496 1/20 0.42
RAB9A P51151 1/20 0.42
BLM P54132 1/20 0.42

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
SCHEMBL7723636 1.00 KMT2A (0.47) KMT2AMAPTMEN1CYP2D6MAPK1
SCHEMBL7726274 0.92 KMT2A (0.49) KMT2AMAPTMEN1CYP2D6MAPK1
SCHEMBL7726279 0.92 KMT2A (0.49) KMT2AMAPTMEN1CYP2D6MAPK1
SCHEMBL7724799 0.90 KMT2A (0.46) KMT2AMAPTMEN1CYP2D6MAPK1
SCHEMBL7724804 0.90 KMT2A (0.46) KMT2AMAPTMEN1CYP2D6MAPK1
SCHEMBL7723481 0.89 KMT2A (0.47) KMT2AMAPTMEN1CYP2D6MAPK1
SCHEMBL7726302 0.89 KMT2A (0.47) KMT2AMAPTMEN1LMNATP53
SCHEMBL7723477 0.89 KMT2A (0.47) KMT2AMAPTMEN1CYP2D6MAPK1
SCHEMBL7726298 0.89 KMT2A (0.47) KMT2AMAPTMEN1LMNATP53
SCHEMBL7723518 0.88 KMT2A (0.44) KMT2AMAPTMEN1CYP2D6MAPK1

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
US-6403586-B1 Pyridazine derivatives and drugs containing the same as the active ingredient KOWA CO., LTD. (JP) 2002-06-11 US disclosed
EP-1061077-A1 NOVEL PYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Kowa Co., Ltd. (JP) 2000-12-20 EP disclosed