SCHEMBL29935784

SCHEMBL29935784

O=Cc1ccnc2c1ccn2CCF

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.44
CCR5 P51681 1/20 0.44
CCR8 P51685 1/20 0.44
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
HSP90AA1 P07900 1/20 0.34
IDO1 P14902 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
FGFR1 P11362 1/20 0.32
FGFR4 P22455 1/20 0.32
DAO P14920 1/20 0.32
MTNR1A P48039 1/20 0.31
HTR6 P50406 1/20 0.30

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
SCHEMBL31132326 1.00 CCR1 (0.44) CCR1CCR5CCR8KDM4EMEN1
SCHEMBL30064747 0.84 CCR1 (0.44) CCR1CCR5CCR8KDM4EMEN1
SCHEMBL9931084 0.84 CCR1 (0.44) CCR1CCR5CCR8KDM4EMEN1
SCHEMBL6909953 0.78 CCR1 (0.48) CCR1CCR5CCR8KDM4EMEN1
SCHEMBL29935619 0.78 CCR1 (0.48) CCR1CCR5CCR8KDM4EMEN1
SCHEMBL24654875 0.77 CCR1 (0.38) CCR1CCR5CCR8KDM4EL3MBTL1
SCHEMBL21893482 0.77 NCF1 (0.35) MTNR1AHTR6
SCHEMBL12148094 0.75 CCR1 (0.48) CCR1CCR5CCR8KDM4EMEN1
SCHEMBL30612066 0.75 CCR1 (0.48) CCR1CCR5CCR8KDM4EMEN1
SCHEMBL24656162 0.73 HTR6 (0.33) MTNR1AHTR6

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 6 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
CN-113164459-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-03 CN 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 CCR1 4485/4885CCR5 4295/4885CCR8 4585/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH CCR1 1712/4885CCR5 1934/4885CCR8 3004/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP CCR1 4485/4885CCR5 4295/4885CCR8 4585/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP CCR1 4485/4885CCR5 4295/4885CCR8 4585/4885

“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.