SCHEMBL29935646

SCHEMBL29935646

O=Cc1c[nH]c2cc(F)ccc12

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 3/20 0.64
CYP2A6 P11509 2/20 0.64
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
MAPT P10636 1/20 0.58
IMPDH2 P12268 1/20 0.56
PLG P00747 1/20 0.55
PLAU P00749 1/20 0.55
GPR84 Q9NQS5 1/20 0.53
IDO1 P14902 1/20 0.51
PIM1 P11309 1/20 0.48
PIM3 Q86V86 1/20 0.48

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
SCHEMBL187434 1.00 TDO2 (0.64) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL7844961 0.86 CYP2A6 (0.57) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL29935857 0.85 CAPN1 (0.59) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL208051 0.85 CAPN1 (0.59) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL15331451 0.82 CYP2A6 (0.53) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL9377060 0.79 CYP2A6 (0.66) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL29956305 0.79 CYP2A6 (0.66) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL19178919 0.78 TDO2 (1.00) TDO2KDM4EALDH1A1MAPTGPR84
SCHEMBL639590 0.78 CYP2A6 (0.64) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL1049957 0.78 PIM3 (0.65) TDO2CYP2A6KDM4EALDH1A1MAPT

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 9 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
WO-2025060786-A1 SIX-MEMBERED AND FIVE-MEMBERED FUSED RING DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 湘北威尔曼制药股份有限公司 2025-03-27 WO disclosed
EP-4313985-A2 HETEROCYCLIC COMPOUNDS AND THEIR USE Equinorm Ltd (FI) 2024-02-07 EP 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-20220389002-A1 Chiral Indole Compounds and Their Use ARIAGEN, INC. (US) 2022-12-08 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 US disclosed
WO-2022207979-A2 NOVEL HETEROCYCLIC COMPOUNDS AND THEIR USE EQUINORM LTD (FI) 2022-10-06 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 (5 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 TDO2 3858/4885CYP2A6 747/4885KDM4E 2437/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH TDO2 1247/4885CYP2A6 555/4885KDM4E 3565/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP TDO2 3858/4885CYP2A6 747/4885KDM4E 2437/4885
US-20220389002-A1 Chiral Indole Compounds and Their Use IDO1, IDO2, INMT TDO2 27/4885CYP2A6 1229/4885KDM4E 1410/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP TDO2 3858/4885CYP2A6 747/4885KDM4E 2437/4885

“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.