SCHEMBL25527883

SCHEMBL25527883

Cc1ccnc2c1CCOC2

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 2/20 0.33
TNKS2 Q9H2K2 2/20 0.33
F12 P00748 2/20 0.33
CCR1 P32246 1/20 0.32
CCR5 P51681 1/20 0.32
CCR8 P51685 1/20 0.32
NOS3 P29474 2/20 0.31
NOS2 P35228 2/20 0.31
TNKS O95271 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
LIMK1 P53667 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL31133463 0.78 WNT3A (0.33) WNT3ATNKS2F12TNKSHTR2A
SCHEMBL20897927 0.78 WNT3A (0.33) WNT3ATNKS2F12TNKSHTR2A
SCHEMBL24656368 0.77 WNT3A (0.32) WNT3ATNKS2TNKS
SCHEMBL31133375 0.75 HSD11B1 (0.36) WNT3ATNKS2TNKS
SCHEMBL21818659 0.75 HSD11B1 (0.36) WNT3ATNKS2TNKS
SCHEMBL795850 0.74 GRM4 (0.40) CCR1CCR5CCR8NOS3NOS2
SCHEMBL795349 0.74 NOS3 (0.44) CCR1CCR5CCR8NOS3NOS2
SCHEMBL21818641 0.73 KDM4E (0.38) WNT3ATNKS2TNKS
SCHEMBL31133332 0.73 KDM4E (0.38) WNT3ATNKS2TNKS
SCHEMBL24283716 0.72 NOS3 (0.42) CCR1CCR5CCR8NOS3NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP WNT3A 3874/4885TNKS2 3411/4885F12 510/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP WNT3A 3874/4885TNKS2 3411/4885F12 510/4885

“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.