SCHEMBL21220686

SCHEMBL21220686

CN1C(=O)CCCc2cc(=O)[nH]cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BMPR1B O00238 1/20 0.38
▸ BMPR1A P36894 1/20 0.38
▸ TGFBR1 P36897 1/20 0.38
▸ ACVRL1 P37023 1/20 0.38
▸ ACVR1 Q04771 1/20 0.38
▸ CYP11B2 P19099 8/20 0.38
▸ CYP11B1 P15538 5/20 0.36
▸ CYP1A2 P05177 2/20 0.34
▸ CYP17A1 P05093 1/20 0.34
▸ CYP19A1 P11511 1/20 0.34
▸ PDE3B Q13370 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ DAO P14920 1/20 0.32
▸ GRIN2D O15399 1/20 0.32
▸ GRIN3B O60391 1/20 0.32
▸ GRIN1 Q05586 1/20 0.32
▸ GRIN2A Q12879 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32
▸ GRIN2C Q14957 1/20 0.32
▸ GRIN3A Q8TCU5 1/20 0.32

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
SCHEMBL20096032 0.87 BMPR1B (0.36) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL4719771 0.72 GRIN2D (0.46) DAOGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL10177054 0.71 ALDH1A1 (0.51) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL21220902 0.71 BMPR1B (0.44) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL19980481 0.70 MAOA (0.49) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL19224681 0.70 BMPR1B (0.49) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL520474 0.70 ATAD2 (0.53) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL30832131 0.70 BMPR1B (0.49) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL8553135 0.70 BMPR1B (0.46) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL29946500 0.68 MEN1 (0.50) CYP1A2GAAKMT2AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12139482-B2 Bicyclic pyridone lactams and methods of use thereof GENENTECH, INC. (US) 2024-11-12 — — US disclosed
EP-3526219-B1 BICYCLIC PYRIDONE LACTAMS AND METHODS OF USE THEREOF HOFFMANN LA ROCHE (CH) 2021-12-15 — — EP disclosed
EP-3526219-B1 BICYCLIC PYRIDONE LACTAMS AND METHODS OF USE THEREOF HOFFMANN LA ROCHE (CH) 2021-12-15 — — EP disclosed
US-20210163475-A1 BICYCLIC PYRIDONE LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-06-03 — — US disclosed
US-20210163475-A1 BICYCLIC PYRIDONE LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-06-03 — — US disclosed
US-10947226-B2 Bicyclic pyridone lactams and methods of use thereof GENENTECH, INC. (US) 2021-03-16 — — US disclosed
US-10947226-B2 Bicyclic pyridone lactams and methods of use thereof GENENTECH, INC. (US) 2021-03-16 — — US disclosed
US-20190241565-A1 BICYCLIC PYRIDONE LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2019-08-08 — — US disclosed
US-20190241565-A1 BICYCLIC PYRIDONE LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2019-08-08 — — 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 (4 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-20210163475-A1 BICYCLIC PYRIDONE LACTAMS AND METHODS OF USE THEREOF CYP3A5, C5, PDXK BMPR1B 313/4885BMPR1A 266/4885TGFBR1 520/4885
US-10947226-B2 Bicyclic pyridone lactams and methods of use thereof CYP3A5, C5, PDXK BMPR1B 313/4885BMPR1A 266/4885TGFBR1 520/4885
US-20190241565-A1 BICYCLIC PYRIDONE LACTAMS AND METHODS OF USE THEREOF CYP3A5, C5, PDXK BMPR1B 313/4885BMPR1A 266/4885TGFBR1 520/4885
US-12139482-B2 Bicyclic pyridone lactams and methods of use thereof CYP3A5, C5, PDXK BMPR1B 313/4885BMPR1A 266/4885TGFBR1 520/4885

“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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