SCHEMBL990908

SCHEMBL990908

O=C(c1ccc(Cl)nc1)N1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 9/20 0.63
RAB9A P51151 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.62
HPGD P15428 6/20 0.61
ALDH1A1 P00352 2/20 0.61
KDM4E B2RXH2 1/20 0.57
POLB P06746 1/20 0.57
ALOX15 P16050 1/20 0.57
HSD17B10 Q99714 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.54
NAPRT Q6XQN6 1/20 0.53

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
SCHEMBL20460596 1.00 GRM5 (0.63) GRM5RAB9AL3MBTL1HPGDALDH1A1
SCHEMBL3242724 0.98 RAB9A (0.65) GRM5RAB9AL3MBTL1HPGDALDH1A1
SCHEMBL31392086 0.98 RAB9A (0.65) GRM5RAB9AL3MBTL1HPGDALDH1A1
SCHEMBL423224 0.95 RAB9A (0.65) GRM5RAB9AL3MBTL1HPGDALDH1A1
SCHEMBL28477730 0.85 RAB9A (0.62) GRM5RAB9AL3MBTL1HPGDALDH1A1
SCHEMBL15444999 0.85 KMT2A (0.68) GRM5RAB9AL3MBTL1HPGDALDH1A1
SCHEMBL524766 0.85 HRH3 (0.59) GRM5RAB9AL3MBTL1HPGDSMN1; SMN2
SCHEMBL712714 0.84 RAB9A (0.68) GRM5RAB9AHPGDKDM4EPOLB
SCHEMBL20460493 0.84 HPGD (0.64) GRM5RAB9AL3MBTL1HPGDALDH1A1
SCHEMBL28392755 0.84 RAB9A (0.60) GRM5RAB9AL3MBTL1HPGDSMN1; SMN2

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 28 patents — showing the first 20. 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
EP-3368533-A1 PYRROLO-, PYRAZOLO-, IMIDAZO-PYRIMIDINE AND PYRIDINE COMPOUNDS THAT INHIBIT MNK1 AND MNK2 Effector Therapeutics Inc. (US) 2018-09-05 EP 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
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
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-20090264435-A1 Novel Aryl- and Heteroarylpiperazines HIGH POINT PHARMACEUTICALS, LLC (US) 2009-10-22 US disclosed
EP-1572215-B1 BENZO[D]AZEPINE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS GLAXO GROUP LTD (GB) 2009-09-02 EP disclosed
EP-2069305-A2 NICOTINIC ACID DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Novartis AG (CH) 2009-06-17 EP disclosed
US-20090005363-A1 Organic Compounds NOVARTIS AG (CH) 2009-01-01 US disclosed
EP-1966144-A1 NICOTINIC ACID DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Novartis AG (CH) 2008-09-10 EP disclosed
WO-2008031550-A2 NICOTINIC ACID DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTANATE RECEPTORS NOVARTIS AG (CH) 2008-03-20 WO disclosed
WO-2007071358-A1 NICOTINIC ACID DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS NOVARTIS AG (CH) 2007-06-28 WO disclosed
EP-1474401-A2 NOVEL ARYL- AND HETEROARYLPIPERAZINES NOVO NORDISK A/S (DK) 2004-11-10 EP disclosed
US-20030236259-A1 Novel aryl- and heteroarylpiperazines HIGH POINT PHARMACEUTICALS, LLC 2003-12-25 US disclosed
WO-2003066604-A2 NOVEL ARYL- AND HETEROARYLPIPERAZINES NOVO NORDISK A/S (DK) 2003-08-14 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 (6 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 GRM5 2046/4885RAB9A 538/4885L3MBTL1 4084/4885
US-20170121339-A1 PYRROLO-, PYRAZOLO-, IMIDAZO-PYRIMIDINE AND PYRIDINE COMPOUNDS THAT INHIBIT MNK1 AND MNK2 NEK9, NEK2, TYK2 GRM5 2047/4885RAB9A 537/4885L3MBTL1 4087/4885
US-20030236259-A1 Novel aryl- and heteroarylpiperazines HRH3, HRH2, HRH4 GRM5 136/4885RAB9A 3350/4885L3MBTL1 3580/4885
US-20090005363-A1 Organic Compounds NNT, NAPRT, CHRNA5 GRM5 680/4885RAB9A 2718/4885L3MBTL1 4844/4885
US-11014926-B2 Pyrrolo-, pyrazolo-, imidazo-pyrimidine and pyridine compounds that inhibit MNK1 and MNK2 NEK9, NEK2, TYK2 GRM5 2046/4885RAB9A 538/4885L3MBTL1 4084/4885
US-20090264435-A1 Novel Aryl- and Heteroarylpiperazines HRH3, HRH2, HRH4 GRM5 136/4885RAB9A 3350/4885L3MBTL1 3580/4885

“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.