SCHEMBL29620360

SCHEMBL29620360

Cc1cc(Oc2c(Cl)cc([N+](=O)[O-])cc2Cl)n[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRA P10827 16/20 0.42
THRB P10828 16/20 0.42
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP2C9 P11712 2/20 0.38
UGT1A1 P22309 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
SLCO1B1 Q9Y6L6 1/20 0.38
CYP2C8 P10632 1/20 0.36

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
SCHEMBL24375474 0.84 THRA (0.61) THRATHRBCYP2C9UGT1A1ABCG2
SCHEMBL29029719 0.81 THRB (0.40) THRATHRBALDH1A1CYP2C9UGT1A1
SCHEMBL24375458 0.81 THRB (0.46) THRATHRBCYP2C9UGT1A1ABCG2
SCHEMBL29620358 0.79 MAPT (0.40) THRATHRBMEN1KMT2A
SCHEMBL29620364 0.79 ALDH1A1 (0.39) THRATHRBALDH1A1MEN1KMT2A
SCHEMBL29620357 0.76 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ACYP2C9
SCHEMBL29527110 0.75 MEN1 (0.45) ALDH1A1MEN1KMT2ACYP2C9
SCHEMBL26027147 0.74 ALDH1A1 (0.39) THRATHRBALDH1A1MEN1KMT2A
SCHEMBL27089947 0.73 PARP1 (0.45) ALDH1A1MEN1KMT2A
SCHEMBL23691262 0.73 MAPT (0.41) ALDH1A1MEN1KMT2ACYP2C9

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