SCHEMBL7723477

SCHEMBL7723477

CCOC(=O)Nc1cc(-c2ccc(OC)cc2)nn(C/C=C/c2ccc(Cl)cc2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
TSHR P16473 4/20 0.46
ALDH1A1 P00352 5/20 0.45
MAPK1 P28482 2/20 0.45
MAPT P10636 4/20 0.44
LMNA P02545 3/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
POLB P06746 2/20 0.43
MEN1 O00255 4/20 0.43
KDM4E B2RXH2 4/20 0.43
HPGD P15428 1/20 0.43
RXFP1 Q9HBX9 2/20 0.41
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
PKM P14618 1/20 0.39
NFKB1 P19838 1/20 0.39
CYP2C19 P33261 1/20 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
SCHEMBL7723481 1.00 KMT2A (0.47) KMT2ATSHRALDH1A1MAPK1MAPT
SCHEMBL7720318 0.92 ALDH1A1 (0.45) KMT2ATSHRALDH1A1MAPK1MAPT
SCHEMBL7720319 0.92 ALDH1A1 (0.45) KMT2ATSHRALDH1A1MAPK1MAPT
SCHEMBL7726274 0.90 KMT2A (0.49) KMT2ATSHRALDH1A1MAPK1MAPT
SCHEMBL7726279 0.90 KMT2A (0.49) KMT2ATSHRALDH1A1MAPK1MAPT
SCHEMBL7723586 0.90 ALDH1A1 (0.43) KMT2ATSHRALDH1A1MAPK1MAPT
SCHEMBL7723587 0.90 ALDH1A1 (0.43) KMT2ATSHRALDH1A1MAPK1MAPT
SCHEMBL7730090 0.89 TACR3 (0.49) KMT2AALDH1A1MAPK1MAPTLMNA
SCHEMBL7730092 0.89 TACR3 (0.49) KMT2AALDH1A1MAPK1MAPTLMNA
SCHEMBL7723636 0.89 KMT2A (0.47) KMT2ATSHRALDH1A1MAPK1MAPT

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 6 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 claimed
EP-1061077-A1 NOVEL PYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Kowa Co., Ltd. (JP) 2000-12-20 EP claimed
US-7211577-B2 Water-soluble phenylpyridazine derivative and medicine containing the same KOWA CO., LTD. (JP) 2007-05-01 US disclosed
US-7211577-B2 Water-soluble phenylpyridazine derivative and medicine containing the same KOWA CO., LTD. (JP) 2007-05-01 US disclosed
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