SCHEMBL24251560

SCHEMBL24251560

Cc1nn2c(C(C)C)c(C(=O)N3CCn4ncnc4C3)ccc2c1-c1c(F)cccc1F

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MYT1 Q01538 3/20 0.38
▸ DPP4 P27487 1/20 0.37
▸ CDK1 P06493 1/20 0.34
▸ WEE1 P30291 1/20 0.34
▸ ELANE P08246 1/20 0.34
▸ P2RX7 Q99572 7/20 0.34
▸ GRM5 P41594 4/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ GABRB3 P28472 1/20 0.33
▸ GABRA5 P31644 1/20 0.33
▸ NOTUM Q6P988 1/20 0.33
▸ HCRTR1 O43613 1/20 0.33
▸ HCRTR2 O43614 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
SCHEMBL24251587 0.83 HPGD (0.44) HCRTR1HCRTR2
SCHEMBL24251538 0.82 SPR (0.42) P2RX7GRM5HCRTR1HCRTR2
SCHEMBL24251459 0.81 SPR (0.42) MYT1CDK1ELANEP2RX7GRM5
SCHEMBL24251483 0.81 P2RX7 (0.53) P2RX7
SCHEMBL24251549 0.80 SPR (0.36) HCRTR1HCRTR2
SCHEMBL24251391 0.80 CYP3A4 (0.37) GABRA5HCRTR1HCRTR2
SCHEMBL24251406 0.78 SPR (0.41) P2RX7GRM5HCRTR1HCRTR2
SCHEMBL24251498 0.78 SPR (0.41) —
SCHEMBL24251385 0.78 SPR (0.40) DPP4HCRTR1HCRTR2
SCHEMBL23355438 0.77 PDE4B (0.35) ELANENOTUM

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-20220048903-A1 Anthelminthic Heterocyclic Compounds BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2022-02-17 — — 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-20220048903-A1 Anthelminthic Heterocyclic Compounds SDHA, PAH, PIGS MYT1 1382/4885DPP4 3480/4885CDK1 1186/4885

“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.

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