SCHEMBL29620357

SCHEMBL29620357

Cc1cc(=O)[nH]nc1Oc1c(Cl)cc([N+](=O)[O-])cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GRIN2D O15399 3/20 0.35
GRIN3B O60391 3/20 0.35
GRIN1 Q05586 3/20 0.35
GRIN2A Q12879 3/20 0.35
GRIN2B Q13224 3/20 0.35
GRIN2C Q14957 3/20 0.35
GRIN3A Q8TCU5 3/20 0.35
HSD17B10 Q99714 1/20 0.34
GPR35 Q9HC97 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.33
MAPT P10636 1/20 0.33
PIK3C3 Q8NEB9 2/20 0.33
GSK3B P49841 1/20 0.33
HTT P42858 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33

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
SCHEMBL29620364 0.82 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AGRIN2DGRIN3B
SCHEMBL24375459 0.81 TNKS2 (0.34) ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29620360 0.76 THRA (0.42) ALDH1A1MEN1KMT2ACYP2C9
SCHEMBL26027147 0.76 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AGRIN2DGRIN3B
SCHEMBL27089947 0.76 PARP1 (0.45) ALDH1A1MEN1KMT2AHSD17B10GPR35
SCHEMBL29620356 0.74 RARG (0.46) ALDH1A1MEN1KMT2AHSD17B10LMNA
SCHEMBL26026549 0.74 RARG (0.46) ALDH1A1MEN1KMT2AHSD17B10LMNA
SCHEMBL26026709 0.72 RARG (0.46) ALDH1A1MEN1KMT2AGRIN2DGRIN3B
SCHEMBL26027642 0.70 TNKS (0.43) ALDH1A1MEN1KMT2ALMNAMAPT
SCHEMBL26027474 0.70 ALDH1A1 (0.33) ALDH1A1ADRA2AADRA2BADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4232436-A1 PROCESS FOR THE PREPARATION OF 6-(4-NITRO-PHENOXY)-2H-PYRIDAZIN-3-ONE AND 6-(4-AMINO-PHENOXY)-2H-PYRIDAZIN-3-ONE DERIVATIVES AS INTERMEDIATES OF THYROID HORMONE ANALOGUES Madrigal Pharmaceuticals, Inc. (US) 2023-08-30 EP disclosed
CN-116406356-A Process for the preparation of 6- (4-nitro-phenoxy) -2H-pyridazin-3-one and 6- (4-amino-phenoxy) -2H-pyridazin-3-one derivatives as intermediates for thyroid hormone analogues 马德里加尔制药公司 2023-07-07 CN disclosed
WO-2022087141-A1 PROCESS FOR THE PREPARATION OF 6-(4-NITRO-PHENOXY)-2H-PYRIDAZIN-3-ONE AND 6-(4-AMINO-PHENOXY)-2H-PYRIDAZIN-3-ONE DERIVATIVES AS INTERMEDIATES OF THYROID HORMONE ANALOGUES MADRIGAL PHARMACEUTICALS, INC. (US) 2022-04-28 WO disclosed