SCHEMBL16110081

SCHEMBL16110081

O=C(O)c1cc(OCc2ccccc2)ccc1C(=O)c1cccc(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 3/20 0.60
▸ RXRA P19793 2/20 0.57
▸ RXRB P28702 2/20 0.57
▸ RXRG P48443 2/20 0.57
▸ SRD5A2 P31213 1/20 0.56
▸ MRGPRX4 Q96LA9 4/20 0.54
▸ MAOB P27338 6/20 0.53
▸ MAOA P21397 3/20 0.53
▸ NPC1 O15118 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ PYGL P06737 1/20 0.49
▸ PYGM P11217 1/20 0.49

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
SCHEMBL10784618 0.83 RXRA (0.68) NR4A2RXRARXRBRXRGSRD5A2
SCHEMBL16136222 0.83 PTPN11 (0.55) PYGLPYGM
SCHEMBL7161222 0.81 MAOB (0.65) NR4A2SRD5A2MAOBCYP1A2CYP2C9
SCHEMBL5112581 0.79 MAOB (0.57) NR4A2RXRARXRBRXRGMRGPRX4
SCHEMBL2902027 0.78 RXRA (0.68) NR4A2RXRARXRBRXRGMRGPRX4
SCHEMBL1115026 0.77 MEN1 (0.67) NR4A2SRD5A2MRGPRX4MAOBNPC1
SCHEMBL2326578 0.77 MEN1 (0.61) NR4A2SRD5A2MRGPRX4MAOBNPC1
SCHEMBL2910095 0.77 MAOB (0.69) NR4A2RXRARXRBRXRGMRGPRX4
SCHEMBL30704729 0.77 NR4A1 (0.66) NPC1RAB9A
SCHEMBL9197822 0.77 NR4A1 (0.66) NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10370366-B2 Pyridazinone compounds and methods for the treatment of cystic fibrosis FLATLEY DISCOVERY LAB, LLC (US) 2019-08-06 — — US disclosed
US-10370366-B2 Pyridazinone compounds and methods for the treatment of cystic fibrosis FLATLEY DISCOVERY LAB, LLC (US) 2019-08-06 — — US disclosed
CN-105307655-B Pyridazinone compound and its be used to prepare treatment tumour shape fibrosis drug application 弗拉特利发现实验室有限责任公司 2019-05-03 — — CN disclosed
US-20180093976-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB LLC (US) 2018-04-05 — — US disclosed
US-20180093976-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB LLC (US) 2018-04-05 — — US disclosed
US-9783529-B2 Pyridazinone compounds and methods for the treatment of cystic fibrosis FLATLEY DISCOVERY LAB, LLC (US) 2017-10-10 — — US disclosed
US-9783529-B2 Pyridazinone compounds and methods for the treatment of cystic fibrosis FLATLEY DISCOVERY LAB, LLC (US) 2017-10-10 — — US disclosed
CN-105307655-A Pyridazinone compounds and methods for the treatment of cystic fibrosis FLATLEY DISCOVERY LAB 2016-02-03 — — CN disclosed
EP-2968323-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS Flatley Discovery Lab (US) 2016-01-20 — — EP disclosed
US-20150005300-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB (US) 2015-01-01 — — US disclosed
WO-2014160440-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB (US) 2014-10-02 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150005300-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, SLC26A4, PNPO NR4A2 2547/4885RXRA 822/4885RXRB 411/4885
US-20180093976-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, SLC26A4, PNPO NR4A2 2547/4885RXRA 822/4885RXRB 411/4885
US-10370366-B2 Pyridazinone compounds and methods for the treatment of cystic fibrosis CFTR, SLC26A4, PNPO NR4A2 2547/4885RXRA 822/4885RXRB 411/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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