SCHEMBL29935996

SCHEMBL29935996

Cc1cc2nccnc2cc1C=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 3/20 0.43
▸ CYP3A4 P08684 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ GRIA1 P42261 1/20 0.42
▸ GRIA2 P42262 1/20 0.42
▸ GRIA3 P42263 1/20 0.42
▸ GRIA4 P48058 1/20 0.42
▸ ALDH1A1 P00352 7/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ TDP2 O95551 1/20 0.38
▸ NGF P01138 1/20 0.38
▸ NTRK1 P04629 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ MPI P34949 1/20 0.37

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
SCHEMBL2491011 0.75 ALDH1A1 (0.48) CYP3A4ALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL2884919 0.75 GRIA1 (0.56) CYP1A2CYP3A4CYP2C19CYP2D6GRIA1
SCHEMBL25249080 0.74 TDP1 (0.48) CYP1A2CYP3A4CYP2C19CYP2D6ALDH1A1
SCHEMBL21816095 0.74 ERN1 (0.37) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL18128766 0.73 GRIA1 (0.54) CYP1A2CYP3A4CYP2C19CYP2D6GRIA1
SCHEMBL11758378 0.72 CCR1 (0.50) CYP1A2CYP3A4CYP2C19CYP2D6ALDH1A1
SCHEMBL13260487 0.71 GRIA1 (0.49) CYP1A2CYP3A4CYP2C19CYP2D6GRIA1
SCHEMBL3687015 0.71 GRIA1 (0.52) CYP1A2CYP3A4CYP2C19CYP2D6GRIA1
SCHEMBL97117 0.71 GRIA1 (0.52) CYP1A2CYP3A4CYP2C19CYP2D6GRIA1
SCHEMBL15445181 0.68 NOS3 (0.47) CYP1A2CYP3A4CYP2C19ALDH1A1SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113164459-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-03 — — CN claimed
US-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 — — US disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 — — US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 — — US disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 — — 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-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP CYP1A2 540/4885CYP3A4 1414/4885CYP2C19 596/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH CYP1A2 611/4885CYP3A4 697/4885CYP2C19 589/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP CYP1A2 540/4885CYP3A4 1414/4885CYP2C19 596/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP CYP1A2 540/4885CYP3A4 1414/4885CYP2C19 596/4885

“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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