SCHEMBL9729576

SCHEMBL9729576

O=CC(c1cccc(Cl)c1)c1cccc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.46
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
AOC3 Q16853 1/20 0.38
CHRM5 P08912 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
SLC6A2 P23975 3/20 0.36
SLC6A4 P31645 3/20 0.36
PARP1 P09874 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
POLB P06746 1/20 0.36
LMNA P02545 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
SCHEMBL1515745 0.94 ACP3 (0.50) ACP3MEN1KMT2AALDH1A1TSHR
SCHEMBL11152058 0.92 ACP3 (0.41) ACP3MEN1KMT2AALDH1A1TSHR
SCHEMBL21778081 0.92 ACP3 (0.41) ACP3MEN1KMT2AALDH1A1TSHR
Methyl Alcohol SCHEMBL11234402 0.89 ACP3 (0.50) ACP3MEN1KMT2AALDH1A1TSHR
SCHEMBL3908501 0.89 TRPM8 (0.40) ACP3MEN1KMT2AALDH1A1AOC3
SCHEMBL3907301 0.88 CYP19A1 (0.41) ACP3MEN1KMT2ACYP1A2CYP2C9
SCHEMBL6501170 0.85 CYP19A1 (0.46) MEN1KMT2AALDH1A1CYP1A2SLC6A2
SCHEMBL15995467 0.85 SLC6A2 (0.41) ACP3MEN1KMT2AALDH1A1CYP1A2
SCHEMBL15331162 0.83 ACP3 (0.46) ACP3MEN1KMT2AALDH1A1TSHR
SCHEMBL6502262 0.82 ACP3 (0.35) ACP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210186969-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF Janssen Biopharma, Inc. (US) 2021-06-24 US disclosed
US-10980805-B2 Aza-pyridone compounds and uses thereof Janssen Biopharma, Inc. (US) 2021-04-20 US disclosed
EP-3030566-B1 7,8-DIHYDRO-3H-PYRAZINO[1,2-B]PYRIDAZINE-3,5(6H)-DIONE COMPOUNDS AND USES THEREOF JANSSEN BIOPHARMA INC (US) 2020-07-08 EP disclosed
US-10702523-B2 AZA-pyridone compounds and uses thereof Janssen Biopharma, Inc. (US) 2020-07-07 US disclosed
US-20200030328-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF Janssen Biopharma, Inc. (US) 2020-01-30 US disclosed
US-20190314373-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF ALIOS BIOPHARMA, INC. (US) 2019-10-17 US disclosed
US-10251882-B2 Aza-pyridone compounds and uses thereof ALIOS BIOPHARMA, INC. (US) 2019-04-09 US disclosed
US-20160228438-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF ALIOS BIOPHARMA, INC. 2016-08-11 US disclosed
US-20160228438-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF ALIOS BIOPHARMA, INC. 2016-08-11 US disclosed
US-9328119-B2 AZA-pyridone compounds and uses thereof ALIOS BIOPHARMA, INC. (US) 2016-05-03 US disclosed
US-9328119-B2 AZA-pyridone compounds and uses thereof ALIOS BIOPHARMA, INC. (US) 2016-05-03 US disclosed
US-20150072982-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF Janssen Pharmaceuticals, Inc. 2015-03-12 US disclosed
US-20150072982-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF Janssen Pharmaceuticals, Inc. 2015-03-12 US disclosed
US-5112988-A ISOINDOLONE DERIVATIVES RHONE-POULENC SANTE (FR) 1992-05-12 US disclosed
US-5102667-A Antiallergens, antiinflammatory agents, nervous system disorders, immunology, psychological disorders RHONE-POULENC SANTE (FR) 1992-04-07 US 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 (8 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-20200030328-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF PNPO, ITPA, PDXK ACP3 1978/4885MEN1 2288/4885KMT2A 1791/4885
US-10980805-B2 Aza-pyridone compounds and uses thereof PNPO, ITPA, PDXK ACP3 1978/4885MEN1 2288/4885KMT2A 1791/4885
US-20190314373-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF PNPO, ITPA, PDXK ACP3 1978/4885MEN1 2288/4885KMT2A 1791/4885
US-10251882-B2 Aza-pyridone compounds and uses thereof PNPO, ITPA, PDXK ACP3 1978/4885MEN1 2288/4885KMT2A 1791/4885
US-20210186969-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF PNPO, ITPA, PDXK ACP3 1978/4885MEN1 2288/4885KMT2A 1791/4885
US-10702523-B2 AZA-pyridone compounds and uses thereof PNPO, ITPA, PDXK ACP3 1978/4885MEN1 2288/4885KMT2A 1791/4885
US-20160228438-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF PNPO, ITPA, PDXK ACP3 1978/4885MEN1 2288/4885KMT2A 1791/4885
US-20150072982-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF PNPO, ITPA, PDXK ACP3 1978/4885MEN1 2288/4885KMT2A 1791/4885

“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.