SCHEMBL24934709

SCHEMBL24934709

CC(C)(C)OC(=O)N1CCC2(CC1)CC(c1ccc(C#N)cc1)C2

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.53
MGLL Q99685 2/20 0.49
CYP3A4 P08684 2/20 0.47
CYP2C19 P33261 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPK1 P28482 1/20 0.47
HSD17B10 Q99714 1/20 0.47
JAK2 O60674 2/20 0.46
JAK3 P52333 1/20 0.46
PTK2 Q05397 1/20 0.46
JAK1 P23458 1/20 0.45
EGLN2 Q96KS0 2/20 0.45
NAMPT P43490 1/20 0.45
GPR183 P32249 1/20 0.45
USP2 O75604 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL18357785 0.88 EGLN2 (0.51) GPR119MGLLJAK2JAK3PTK2
SCHEMBL23867867 0.85 GPR119 (0.52) GPR119MGLLNAMPT
SCHEMBL21837021 0.84 RORC (0.49) GPR119NAMPT
SCHEMBL6132557 0.84 GPR119 (0.64) GPR119JAK2JAK3PTK2EGLN2
SCHEMBL20396154 0.84 GPR119 (0.46) GPR119JAK2JAK1EGLN2NAMPT
SCHEMBL20399225 0.84 MGLL (0.71) GPR119MGLLCYP3A4CYP2C19ALDH1A1
SCHEMBL23868051 0.83 ALDH1A1 (0.54) GPR119MGLLALDH1A1NAMPTCYP2D6
SCHEMBL29324613 0.82 GPR119 (0.46) GPR119NAMPT
SCHEMBL30981442 0.82 NAMPT (0.54) GPR119CYP3A4CYP2C19ALDH1A1NAMPT
SCHEMBL15601524 0.81 GPR119 (0.54) GPR119JAK2JAK3PTK2EGLN2

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-20230022770-A1 NOVEL PYRIDAZINES BOEHRINGER INGELHEIM INT (DE) 2023-01-26 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-20230022770-A1 NOVEL PYRIDAZINES ENPP2, PLPBP, PRDX6 GPR119 1166/4885MGLL 3708/4885CYP3A4 3173/4885

“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.