SCHEMBL24656173

SCHEMBL24656173

COC(=O)Cc1cccn2ncc(F)c12

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 4/20 0.35
MAPT P10636 2/20 0.35
P2RX7 Q99572 2/20 0.35
EPHB3 P54753 3/20 0.34
KDM4E B2RXH2 1/20 0.34
DRD2 P14416 1/20 0.34
DRD4 P21917 1/20 0.34
DRD3 P35462 1/20 0.34
HPGD P15428 3/20 0.34
LMNA P02545 3/20 0.34
HSD17B10 Q99714 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
RORC P51449 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33

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
SCHEMBL24339334 0.76 DRD2 (0.46) SMN1; SMN2ALDH1A1MAPTP2RX7EPHB3
SCHEMBL21819232 0.76 LMNA (0.46) SMN1; SMN2ALDH1A1EPHB3KDM4ELMNA
SCHEMBL661699 0.71 TAAR1 (0.51) SMN1; SMN2ALDH1A1MAPTKDM4EHPGD
SCHEMBL30874634 0.71 TAAR1 (0.51) SMN1; SMN2ALDH1A1MAPTKDM4EHPGD
Hydrochloric Acid SCHEMBL27592315 0.70 TAAR1 (0.50) SMN1; SMN2ALDH1A1MAPTKDM4EHPGD
SCHEMBL21818673 0.69 POLB (0.42) SMN1; SMN2ALDH1A1MAPTEPHB3KDM4E
SCHEMBL30301470 0.69 MAPK14 (0.37) EPHB3
SCHEMBL30431086 0.69 DRD2 (0.46) SMN1; SMN2ALDH1A1MAPTEPHB3KDM4E
SCHEMBL506923 0.68 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1P2RX7KDM4ELMNA
SCHEMBL1554320 0.68 KDM4E (0.53) SMN1; SMN2ALDH1A1MAPTKDM4EHPGD

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 SMN1; SMN2 3418/4885ALDH1A1 312/4885MAPT 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.