SCHEMBL21099276

SCHEMBL21099276

CC(C)(C)Nc1nc(Cl)nc2c1SCC2

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ CYP1A2 P05177 1/20 0.35
▸ PDE4A P27815 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ KMT2A Q03164 1/20 0.31
▸ GAA P10253 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL187242 0.76 — —
SCHEMBL23084550 0.74 NPC1 (0.30) SMN1; SMN2NPC1MAPTRAB9A
SCHEMBL11112029 0.72 PDE4B (0.35) —
SCHEMBL588750 0.71 NPC1 (0.35) SMN1; SMN2KMT2ANPC1MAPTRAB9A
SCHEMBL23068559 0.71 — —
SCHEMBL2270436 0.70 LMNA (0.41) SMN1; SMN2LMNACYP1A2PDE4ACYP2C19
SCHEMBL373987 0.70 CDK1 (0.32) CYP1A2CYP2C19KMT2AMAPT
SCHEMBL31622413 0.70 — —
SCHEMBL13638690 0.69 NPC1 (0.35) SMN1; SMN2KMT2ANPC1MAPTRAB9A
SCHEMBL19624252 0.69 — —

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11299497-B2 Substituted tetrahydropyran dihydrothienopyrimidines and their use as phosphodiesterase inhibitors UNION therapeutics A/S (DK) 2022-04-12 — — US disclosed
US-20200385400-A1 SUBSTITUTED TETRAHYDROPYRAN DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION therapeutics A/S (DK) 2020-12-10 — — US disclosed
WO-2019115775-A1 SUBSTITUTED TETRAHYDROPYRAN DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2019-06-20 — — WO 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 (2 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-11299497-B2 Substituted tetrahydropyran dihydrothienopyrimidines and their use as phosphodiesterase inhibitors PDE5A, PDE4A, PDE7A SMN1; SMN2 1900/4885LMNA 3148/4885CYP1A2 939/4885
US-20200385400-A1 SUBSTITUTED TETRAHYDROPYRAN DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS PDE5A, PDE4A, PDE7A SMN1; SMN2 1900/4885LMNA 3148/4885CYP1A2 939/4885

“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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