SCHEMBL26029318

SCHEMBL26029318

CC(C)(C)c1ccc2nccc(Br)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 4/20 0.47
GAK O14976 4/20 0.47
NLK Q9UBE8 3/20 0.47
COQ8A Q8NI60 2/20 0.47
FGFR2 P21802 2/20 0.38
LRRK2 Q5S007 1/20 0.38
FGFR1 P11362 1/20 0.37
FLT3 P36888 1/20 0.37
CLK4 Q9HAZ1 1/20 0.37
HTR1A P08908 1/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
HTR6 P50406 1/20 0.36
METAP2 P50579 1/20 0.36
SLC22A12 Q96S37 1/20 0.36
KDR P35968 1/20 0.35
MAPK14 Q16539 1/20 0.35
KIF11 P52732 1/20 0.35
KCNH2 Q12809 1/20 0.35
SCN10A Q9Y5Y9 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
SCHEMBL8547469 0.82 CCNC (0.48) RIPK2GAKNLKCOQ8ACLK4
SCHEMBL31510479 0.82 CCNC (0.48) RIPK2GAKNLKCOQ8ACLK4
SCHEMBL17811239 0.80 RIPK2 (0.48) RIPK2GAKNLKCOQ8AFGFR2
SCHEMBL17257647 0.80 SMN1; SMN2 (0.53) RIPK2GAKNLKCOQ8AFGFR2
SCHEMBL15043742 0.79 ALDH1A1 (0.47) RIPK2GAKNLKCOQ8AFGFR2
SCHEMBL15043734 0.79 RIPK2 (0.47) RIPK2GAKNLKCOQ8AFGFR2
SCHEMBL12025111 0.79 NR4A2 (0.56) RIPK2GAKNLKCOQ8AFGFR2
SCHEMBL19499073 0.76 RIPK2 (0.45) RIPK2GAKNLKCOQ8AFGFR2
SCHEMBL13676601 0.76 GAK (0.45) RIPK2GAKNLKCOQ8AFGFR2
SCHEMBL13676600 0.76 RIPK2 (0.45) RIPK2GAKNLKCOQ8AFGFR2

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-20230242531-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-08-03 US disclosed
US-20230242531-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-08-03 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-20230242531-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP RIPK2 2876/4885GAK 1750/4885NLK 1718/4885

“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.