SCHEMBL29935595

SCHEMBL29935595

c1ccc(-n2cc3c(n2)CNCC3)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 5/20 0.46
▸ PNMT P11086 1/20 0.43
▸ CD44 P16070 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ HTR2B P41595 2/20 0.40
▸ HTR2A P28223 1/20 0.39
▸ PRCP P42785 1/20 0.37
▸ PARP1 P09874 2/20 0.37
▸ PARP2 Q9UGN5 2/20 0.37
▸ PARP3 Q9Y6F1 2/20 0.37
▸ PTGS2 P35354 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ AADAT Q8N5Z0 3/20 0.36
▸ OGA O60502 1/20 0.35

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
SCHEMBL1171436 0.89 HTR2C (0.57) HTR2CHTR2BHTR2AESR2AADAT
SCHEMBL2178294 0.87 HTR2C (0.46) HTR2CPNMTCD44MAOBHTR2B
Hydrochloric Acid SCHEMBL12540386 0.86 HTR2C (0.44) HTR2CPNMTCD44MAOBHTR2B
SCHEMBL12478204 0.85 PTGS2 (0.39) PTGS2ESR2AADAT
SCHEMBL29689440 0.79 HTR2C (0.33) HTR2CPNMTCD44MAOBPARP1
SCHEMBL20792560 0.79 PLD1 (0.43) HTR2CPNMTCD44MAOBHTR2B
SCHEMBL7926379 0.76 HTT (0.44) ESR2AADATOGA
SCHEMBL4837573 0.75 HTR2C (0.40) HTR2CHTR2BHTR2A
SCHEMBL19549732 0.75 CD274 (0.49) HTR2CHTR2APRCPCYP3A4
SCHEMBL21041601 0.74 HTR2C (0.81) HTR2CPNMTCD44MAOBHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 HTR2C 516/4885PNMT 2940/4885CD44 4870/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH HTR2C 128/4885PNMT 2239/4885CD44 4874/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP HTR2C 516/4885PNMT 2940/4885CD44 4870/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP HTR2C 516/4885PNMT 2940/4885CD44 4870/4885

“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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