SCHEMBL269264

SCHEMBL269264

Cc1cc2ccc(Br)cc2cn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.57
CYP1A2 P05177 2/20 0.57
ABL1 P00519 2/20 0.47
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
UHRF1 Q96T88 1/20 0.39
CCR1 P32246 1/20 0.39
CCR5 P51681 1/20 0.39
CCR8 P51685 1/20 0.39
NOS1 P29475 2/20 0.38
METAP2 P50579 2/20 0.38
BACE1 P56817 2/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 1/20 0.38
CSNK2A1 P68400 1/20 0.38

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
SCHEMBL6845001 0.92 CYP2A6 (0.57) CYP2A6CYP1A2ABL1KDM4EMEN1
SCHEMBL18266963 0.79 CYP1A2 (0.67) CYP2A6CYP1A2ABL1KDM4EALDH1A1
SCHEMBL8404528 0.78 CYP1A2 (0.61) CYP2A6CYP1A2ABL1KDM4EALDH1A1
SCHEMBL29404737 0.78 CYP1A2 (0.61) CYP2A6CYP1A2ABL1KDM4EALDH1A1
SCHEMBL12991382 0.77 CYP1A2 (0.59) CYP2A6CYP1A2ABL1UHRF1CCR1
SCHEMBL8166969 0.76 CYP1A2 (0.52) CYP2A6CYP1A2UHRF1CCR1CCR5
SCHEMBL24207389 0.75 CYP2A6 (0.57) CYP2A6CYP1A2ABL1KDM4EMEN1
SCHEMBL933672 0.75 CYP2A6 (0.46) CYP2A6CYP1A2ABL1KDM4EMEN1
SCHEMBL18574394 0.75 CYP1A2 (0.57) CYP2A6CYP1A2ABL1MAPTUHRF1
SCHEMBL23676624 0.75 CYP1A2 (0.57) CYP2A6CYP1A2ABL1UHRF1CCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119119033-A Pyrazolopyridone compounds 百济神州有限公司 2024-12-13 CN disclosed
US-20240300951-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-09-12 US disclosed
US-20240270751-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-08-15 US disclosed
EP-4380936-A1 PYRAZOLOPYRIDINONE COMPOUNDS BeiGene, Ltd. (KY) 2024-06-12 EP disclosed
CN-117836296-A Pyrazolopyridone compounds 百济神州有限公司 2024-04-05 CN disclosed
WO-2023011456-A1 PYRAZOLOPYRIDINONE COMPOUNDS BEIGENE, LTD. (KY) 2023-02-09 WO disclosed
US-10106558-B2 Azolobenzazine compounds, compositions comprising these compounds and their use for controlling invertebrate pests BASF SE (DE) 2018-10-23 US disclosed
US-20180002346-A1 AZOLOBENZAZINE COMPOUNDS, COMPOSITIONS COMPRISING THESE COMPOUNDS AND THEIR USE FOR CONTROLLING INVERTEBRATE PESTS BASF SE (DE) 2018-01-04 US disclosed
EP-3245205-A1 AZOLOBENZAZINE COMPOUNDS, COMPOSITIONS COMPRISING THESE COMPOUNDS AND THEIR USE FOR CONTROLLING INVERTEBRATE PESTS BASF SE (DE) 2017-11-22 EP disclosed
WO-2016113272-A1 AZOLOBENZAZINE COMPOUNDS, COMPOSITIONS COMPRISING THESE COMPOUNDS AND THEIR USE FOR CONTROLLING INVERTEBRATE PESTS BASF SE (DE) 2016-07-21 WO disclosed
US-20160101104-A1 QUINUCLIDINE COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS BRISTOL MYERS SQUIBB CO (US) 2016-04-14 US disclosed
US-20150094309-A1 QUINUCLIDINE COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS BRISTOL MYERS SQUIBB CO (US) 2015-04-02 US disclosed
US-20140221377-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands BRISTOL MYERS SQUIBB CO (US) 2014-08-07 US disclosed
US-20130131064-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands BRISTOL-MYERS SQUIBB COMPANY (US) 2013-05-23 US disclosed
US-8134004-B2 Substituted N-bicyclicalkyl bicycliccarboxyamide compounds PFIZER INC. (US) 2012-03-13 US disclosed
WO-2011053292-A1 QUINUCLIDINE COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS BRISTOL-MYERS SQUIBB COMPANY (US) 2011-05-05 WO disclosed
US-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS PFIZER INC 2009-10-08 US disclosed
US-20040116399-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2004-06-17 US disclosed
US-20040116399-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2004-06-17 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 (9 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-10106558-B2 Azolobenzazine compounds, compositions comprising these compounds and their use for controlling invertebrate pests DDT, CRY1, TH CYP2A6 1121/4885CYP1A2 43/4885ABL1 495/4885
US-20180002346-A1 AZOLOBENZAZINE COMPOUNDS, COMPOSITIONS COMPRISING THESE COMPOUNDS AND THEIR USE FOR CONTROLLING INVERTEBRATE PESTS DDT, CRY1, TH CYP2A6 1121/4885CYP1A2 43/4885ABL1 495/4885
US-20140221377-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands CHRNA7, CHRNA5, CHRNA6 CYP2A6 2357/4885CYP1A2 2027/4885ABL1 2144/4885
US-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS OPRL1, CNR1, TRPV1 CYP2A6 600/4885CYP1A2 882/4885ABL1 2761/4885
US-20130131064-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands CHRNA7, CHRNA5, CHRNA6 CYP2A6 2357/4885CYP1A2 2027/4885ABL1 2144/4885
US-20160101104-A1 QUINUCLIDINE COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA7, CHRNA5, CHRNA6 CYP2A6 2357/4885CYP1A2 2027/4885ABL1 2144/4885
US-20240300951-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK CYP2A6 3696/4885CYP1A2 2016/4885ABL1 687/4885
US-20240270751-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK CYP2A6 3696/4885CYP1A2 2016/4885ABL1 687/4885
US-20150094309-A1 QUINUCLIDINE COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA7, CHRNA5, CHRNA6 CYP2A6 2357/4885CYP1A2 2027/4885ABL1 2144/4885

“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.