SCHEMBL24809669

SCHEMBL24809669

CC(C)c1cccnc1N1CCC(N2CCOCC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.43
KDM2B Q8NHM5 1/20 0.43
HRH3 Q9Y5N1 6/20 0.42
CYP2C9 P11712 3/20 0.41
CYP1A2 P05177 2/20 0.41
ELANE P08246 1/20 0.41
AOC3 Q16853 1/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C19 P33261 2/20 0.41
CHRM4 P08173 1/20 0.40
CXCR4 P61073 1/20 0.39
KMT2A Q03164 1/20 0.38

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
SCHEMBL10094264 0.86 CYP1A2 (0.52) CYP2C9CYP1A2
SCHEMBL24809678 0.86 ELANE (0.48) ELANECHRM4CXCR4KMT2A
SCHEMBL10094245 0.76 CYP1A2 (0.49) CYP2C9CYP1A2CYP3A4CYP2C19KMT2A
SCHEMBL26790144 0.76 CYP1A2 (0.45) CYP2C9CYP1A2CYP3A4CYP2C19KMT2A
SCHEMBL2609324 0.74 CYP1A2 (0.51) CYP2C9CYP1A2CYP3A4CYP2C19KMT2A
SCHEMBL11951657 0.74 PDE10A (0.42) HRH3KMT2A
SCHEMBL10094290 0.74 PDE10A (0.42) HRH3KMT2A
SCHEMBL10094284 0.74 PDE10A (0.42) HRH3KMT2A
SCHEMBL19107154 0.73 HRH4 (0.50) ELANE
SCHEMBL21024668 0.73 CYP1A2 (0.48) CYP2C9CYP1A2KMT2A

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-20220411388-A1 SUBSTITUTED IMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2022-12-29 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-20220411388-A1 SUBSTITUTED IMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GAA, CLN6 IRAK4 154/4885KDM2B 327/4885HRH3 256/4885

“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.