SCHEMBL29620358

SCHEMBL29620358

O=c1[nH]nc(Oc2c(Cl)cc([N+](=O)[O-])cc2Cl)cc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
LMNA P02545 2/20 0.40
THRA P10827 6/20 0.39
THRB P10828 6/20 0.39
TDP1 Q9NUW8 1/20 0.39
HPGD P15428 2/20 0.38
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
CCNE2 O96020 1/20 0.37
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
PDE4D Q08499 1/20 0.36
GUSB P08236 1/20 0.35
HCRTR1 O43613 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL24375472 0.83 THRA (0.41) THRATHRBHPGD
SCHEMBL29620360 0.79 THRA (0.42) MEN1KMT2ATHRATHRB
SCHEMBL22668190 0.76 THRB (0.66) THRATHRB
SCHEMBL29029719 0.76 THRB (0.40) MAPTLMNATHRATHRBHPGD
SCHEMBL24375474 0.76 THRA (0.61) THRATHRB
SCHEMBL22660385 0.75 THRB (0.50) THRATHRB
SCHEMBL29620356 0.75 RARG (0.46) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL26026549 0.75 RARG (0.46) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL22668193 0.74 THRB (0.53) THRATHRB
SCHEMBL22660394 0.73 THRB (0.49) THRATHRB

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