SCHEMBL24809671

SCHEMBL24809671

CCOc1nc(-c2ccc(OC)nc2)cn1C(=O)NCCC1CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 3/20 0.41
CD274 Q9NZQ7 1/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
KDR P35968 1/20 0.37
PDE5A O76074 2/20 0.37
DGAT1 O75907 1/20 0.37
ADORA2A P29274 1/20 0.37
KCNH2 Q12809 1/20 0.37
JAK1 P23458 2/20 0.36
JAK2 O60674 1/20 0.36
TYK2 P29597 1/20 0.36
JAK3 P52333 1/20 0.36
NAMPT P43490 6/20 0.36
HPGD P15428 1/20 0.36
JMJD6 Q6NYC1 1/20 0.35
CHRM4 P08173 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
SCHEMBL29817764 1.00 PIK3CA (0.41) PIK3CACD274PIK3CDPIK3CBPIK3CG
SCHEMBL24810831 0.83 TP53 (0.39) NAMPTCHRM4
SCHEMBL29817577 0.83 TP53 (0.39) NAMPTCHRM4
SCHEMBL29817459 0.79 CHRM4 (0.39) NAMPTHPGDCHRM4
SCHEMBL24811117 0.79 CHRM4 (0.39) NAMPTHPGDCHRM4
SCHEMBL24810566 0.79 PIK3CA (0.44) PIK3CACD274PIK3CDKDRJAK1
SCHEMBL29817539 0.79 PIK3CA (0.44) PIK3CACD274PIK3CDKDRJAK1
SCHEMBL24810558 0.77 ASAH1 (0.40) NAMPTCHRM4
SCHEMBL29817766 0.77 ASAH1 (0.40) NAMPTCHRM4
SCHEMBL24809462 0.76 MTNR1A (0.33) JAK1JAK2JAK3CHRM4

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-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
CN-114787135-A Substituted imidazole carboxamides and their use in the treatment of medical disorders 比亚尔R&D投资股份公司 2022-07-22 CN 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 PIK3CA 892/4885CD274 4748/4885PIK3CD 970/4885

“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.