SCHEMBL18789183

SCHEMBL18789183

O=C1NC2(CCCCC2)c2cc(-n3ccc4cncnc43)cc(Cl)c21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MKNK2 Q9HBH9 11/20 1.00
▸ MKNK1 Q9BUB5 2/20 0.45
▸ PDE7A Q13946 8/20 0.34
▸ PDE5A O76074 3/20 0.34
▸ PDE1A P54750 3/20 0.34
▸ PDE1B Q01064 3/20 0.34
▸ PDE4D Q08499 3/20 0.34
▸ PDE1C Q14123 3/20 0.34
▸ PDE3A Q14432 3/20 0.34
▸ DGAT1 O75907 1/20 0.32
▸ PDE7B Q9NP56 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
SCHEMBL18789202 0.99 MKNK2 (0.98) MKNK2MKNK1PDE7APDE5APDE1A
SCHEMBL18789200 0.84 MKNK2 (0.72) MKNK2MKNK1DGAT1
SCHEMBL18789212 0.82 MKNK2 (0.69) MKNK2MKNK1PDE7APDE5APDE1A
SCHEMBL18804762 0.81 MKNK2 (0.68) MKNK2PDE7APDE5APDE1APDE1B
SCHEMBL18789153 0.80 MKNK2 (0.67) MKNK2MKNK1PDE7ADGAT1
SCHEMBL18789219 0.72 MKNK2 (0.56) MKNK2MKNK1PDE1B
SCHEMBL18804764 0.72 MKNK2 (0.56) MKNK2PDE7A
SCHEMBL18789173 0.71 MKNK2 (1.00) MKNK2MKNK1DGAT1
SCHEMBL18814529 0.71 MKNK2 (0.55) MKNK2MKNK1DGAT1
SCHEMBL18789123 0.71 MKNK2 (0.55) MKNK2MKNK1PDE1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11014926-B2 Pyrrolo-, pyrazolo-, imidazo-pyrimidine and pyridine compounds that inhibit MNK1 and MNK2 EFFECTOR THERAPEUTICS, INC. (US) 2021-05-25 — — US disclosed
US-11014926-B2 Pyrrolo-, pyrazolo-, imidazo-pyrimidine and pyridine compounds that inhibit MNK1 and MNK2 EFFECTOR THERAPEUTICS, INC. (US) 2021-05-25 — — US disclosed
US-20190330216-A1 PYRROLO-, PYRAZOLO-, IMIDAZO-PYRIMIDINE AND PYRIDINE COMPOUNDS THAT INHIBIT MNK1 AND MNK2 OXFORD FINANCE LLC, AS COLLATERAL AGENT 2019-10-31 — — US disclosed
US-20190330216-A1 PYRROLO-, PYRAZOLO-, IMIDAZO-PYRIMIDINE AND PYRIDINE COMPOUNDS THAT INHIBIT MNK1 AND MNK2 OXFORD FINANCE LLC, AS COLLATERAL AGENT 2019-10-31 — — US disclosed
WO-2017075412-A1 PYRROLO-, PYRAZOLO-, IMIDAZO-PYRIMIDINE AND PYRIDINE COMPOUNDS THAT INHIBIT MNK1 AND MNK2 EFFECTOR THERAPEUTICS, INC. (US) 2017-05-04 — — WO disclosed
US-20170121339-A1 PYRROLO-, PYRAZOLO-, IMIDAZO-PYRIMIDINE AND PYRIDINE COMPOUNDS THAT INHIBIT MNK1 AND MNK2 EFFECTOR THERAPEUTICS INC (US) 2017-05-04 — — US disclosed
US-20170121339-A1 PYRROLO-, PYRAZOLO-, IMIDAZO-PYRIMIDINE AND PYRIDINE COMPOUNDS THAT INHIBIT MNK1 AND MNK2 EFFECTOR THERAPEUTICS INC (US) 2017-05-04 — — US disclosed
US-20170121339-A1 PYRROLO-, PYRAZOLO-, IMIDAZO-PYRIMIDINE AND PYRIDINE COMPOUNDS THAT INHIBIT MNK1 AND MNK2 EFFECTOR THERAPEUTICS INC (US) 2017-05-04 — — 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 (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-20190330216-A1 PYRROLO-, PYRAZOLO-, IMIDAZO-PYRIMIDINE AND PYRIDINE COMPOUNDS THAT INHIBIT MNK1 AND MNK2 NEK9, NEK2, TYK2 MKNK2 37/4885MKNK1 67/4885PDE7A 925/4885
US-20170121339-A1 PYRROLO-, PYRAZOLO-, IMIDAZO-PYRIMIDINE AND PYRIDINE COMPOUNDS THAT INHIBIT MNK1 AND MNK2 NEK9, NEK2, TYK2 MKNK2 38/4885MKNK1 67/4885PDE7A 918/4885
US-11014926-B2 Pyrrolo-, pyrazolo-, imidazo-pyrimidine and pyridine compounds that inhibit MNK1 and MNK2 NEK9, NEK2, TYK2 MKNK2 37/4885MKNK1 67/4885PDE7A 925/4885

“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.

Send feedback