SCHEMBL24656172

SCHEMBL24656172

O=C(O)Cc1cccn2nccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
CYP1A2 P05177 1/20 0.45
MAPT P10636 1/20 0.45
AKR1B1 P15121 2/20 0.44
PTGS2 P35354 1/20 0.44
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42
DRD3 P35462 1/20 0.42
TDP1 Q9NUW8 1/20 0.40
TBXAS1 P24557 1/20 0.38
AXL P30530 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
CTDSP1 Q9GZU7 2/20 0.36
DUSP3 P51452 1/20 0.36
PTPN5 P54829 1/20 0.36
PTPN11 Q06124 1/20 0.36
BCAT2 O15382 1/20 0.36
ALDH1A1 P00352 1/20 0.36
NSD2 O96028 1/20 0.35
POLB P06746 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
SCHEMBL3460309 0.78 DRD3 (0.46) KDM4EMAPTDRD2DRD4DRD3
SCHEMBL1290470 0.78 DRD3 (0.50) KDM4EAKR1B1DRD2DRD4DRD3
SCHEMBL8916169 0.74 AKR1B1 (0.50) KDM4ECYP1A2MAPTAKR1B1PTGS2
SCHEMBL19489536 0.72 AKR1B1 (0.51) CYP1A2AKR1B1PTGS2CTDSP1ALDH1A1
SCHEMBL19431253 0.70 DRD4 (0.43) DRD2DRD4DRD3
SCHEMBL28615308 0.70 ALDH1A1 (0.44) MAPTALDH1A1POLB
SCHEMBL7381477 0.68 NPC1 (0.48) KDM4EMAPTDRD2DRD4DRD3
SCHEMBL3458337 0.68 JAK2 (0.46) KDM4EMAPTALDH1A1
SCHEMBL24338066 0.68 PTGS2 (0.37) KDM4ECYP1A2MAPTAKR1B1PTGS2
SCHEMBL12540739 0.68 KDM4E (0.47) KDM4ECYP1A2MAPTAKR1B1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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 KDM4E 2437/4885CYP1A2 540/4885MAPT 2516/4885

“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.