SCHEMBL17629965

SCHEMBL17629965

COC(=O)c1ccnc(C2CCC2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.55
KDM6B O15054 2/20 0.55
KDM5C P41229 2/20 0.55
KDM4C Q9H3R0 2/20 0.55
KDM2A Q9Y2K7 2/20 0.55
KDM3A Q9Y4C1 2/20 0.55
JMJD6 Q6NYC1 3/20 0.49
ALOX15 P16050 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PROKR1 Q8TCW9 2/20 0.46
HRH3 Q9Y5N1 2/20 0.45
MAOB P27338 1/20 0.44
KDM5B Q9UGL1 1/20 0.42
HTT P42858 1/20 0.42
HDAC4 P56524 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HDAC3 O15379 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL30016171 0.97 KDM4E (0.55) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL16445734 0.94 KDM4E (0.58) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL30755291 0.87 KDM4E (0.51) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL27370534 0.87 KDM4E (0.51) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL31320054 0.86 KDM4E (0.50) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL26087368 0.81 KDM4C (0.50) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL30379389 0.81 KDM4C (0.50) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL25702318 0.78 JMJD6 (0.54) KDM4EKDM5CKDM4CJMJD6PROKR1
SCHEMBL30016583 0.78 JMJD6 (0.54) KDM4EKDM5CKDM4CJMJD6PROKR1
SCHEMBL16055561 0.78 KMO (0.53) KDM4EKDM6BKDM5CKDM4CKDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023070053-A1 INHIBITORS OF RAF KINASES KINNATE BIOPHARMA INC. (US) 2023-04-27 WO disclosed
WO-2023070053-A1 INHIBITORS OF RAF KINASES KINNATE BIOPHARMA INC. (US) 2023-04-27 WO disclosed
US-20190152979-A1 SUBSTITUTED PYRAZOLOQUINAZOLINONES AND PYRROLOQUINAZOLINONES AS ALLOSTERIC MODULATORS OF GROUP II METABOTROPIC GLUTAMATE RECEPTORS DOMAIN THERAPEUTICS (FR) 2019-05-23 US disclosed
US-10221179-B2 Substituted pyrazoloquinazolinones and pyrroloquinazolinones as allosteric modulators of group II metabotropic glutamate receptors DOMAIN THERAPEUTICS (FR) 2019-03-05 US disclosed
US-20170305913-A1 SUBSTITUTED PYRAZOLOQUINAZOLINONES AND PYRROLOQUINAZOLINONES AS ALLOSTERIC MODULATORS OF GROUP II METABOTROPIC GLUTAMATE RECEPTORS DOMAIN THERAPEUTICS (FR) 2017-10-26 US disclosed
EP-3197897-A1 SUBSTITUTED PYRAZOLOQUINAZOLINONES AND PYRROLOQUINAZOLINONES AS ALLOSTERIC MODULATORS OF GROUP IIMETABOTROPIC GLUTAMATE RECEPTORS Domain Therapeutics (FR) 2017-08-02 EP disclosed
WO-2016046404-A1 SUBSTITUTED PYRAZOLOQUINAZOLINONES AND PYRROLOQUINAZOLINONES AS ALLOSTERIC MODULATORS OF GROUP IIMETABOTROPIC GLUTAMATE RECEPTORS DOMAIN THERAPEUTICS (FR) 2016-03-31 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 (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-10221179-B2 Substituted pyrazoloquinazolinones and pyrroloquinazolinones as allosteric modulators of group II metabotropic glutamate receptors GRM1, GRM2, GRIN1 KDM4E 2164/4885KDM6B 2638/4885KDM5C 1939/4885
US-20170305913-A1 SUBSTITUTED PYRAZOLOQUINAZOLINONES AND PYRROLOQUINAZOLINONES AS ALLOSTERIC MODULATORS OF GROUP II METABOTROPIC GLUTAMATE RECEPTORS GRM1, GRM2, GRIN1 KDM4E 2164/4885KDM6B 2638/4885KDM5C 1939/4885
US-20190152979-A1 SUBSTITUTED PYRAZOLOQUINAZOLINONES AND PYRROLOQUINAZOLINONES AS ALLOSTERIC MODULATORS OF GROUP II METABOTROPIC GLUTAMATE RECEPTORS GRM1, GRM2, GRIN1 KDM4E 2238/4885KDM6B 2611/4885KDM5C 2149/4885

“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.