SCHEMBL21470958

SCHEMBL21470958

CC1c2cc(OC(=O)OC(C)(C)C)cnc2CCN1C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.35
▸ GPR119 Q8TDV5 7/20 0.34
▸ MAPT P10636 2/20 0.34
▸ OGA O60502 1/20 0.33
▸ GHSR Q92847 4/20 0.33
▸ NR1H2 P55055 1/20 0.33
▸ KDM1A O60341 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ UCHL1 P09936 1/20 0.32

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
SCHEMBL23326761 0.91 ELANE (0.35) ELANEGPR119MAPTOGAKDM1A
SCHEMBL21470756 0.85 ESR2 (0.38) GPR119MAPTGHSRNR1H2SMN1; SMN2
SCHEMBL31569123 0.79 GPR119 (0.39) GPR119MAPTUCHL1
SCHEMBL31569021 0.79 GPR119 (0.39) GPR119MAPTUCHL1
SCHEMBL31505358 0.78 GHSR (0.45) ELANEGHSRNR1H2SMN1; SMN2
SCHEMBL31505321 0.77 MAP4K4 (0.36) GHSRNR1H2UCHL1
SCHEMBL31568944 0.76 ESR2 (0.36) ELANEMAPTGHSRNR1H2SMN1; SMN2
SCHEMBL31569084 0.76 POLB (0.44) GPR119MAPT
SCHEMBL31569147 0.76 POLB (0.44) GPR119MAPT
SCHEMBL21470478 0.76 HDAC8 (0.38) ELANEGPR119

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-20210139484-A1 DIHYDROISOQUINOLINE-2(1H)-CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS GOSSAMER BIO SERVICES INC (US) 2021-05-13 — — US disclosed
US-20210139484-A1 DIHYDROISOQUINOLINE-2(1H)-CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS GOSSAMER BIO SERVICES INC (US) 2021-05-13 — — US disclosed
WO-2019200120-A1 DIHYDROISOQUINOLINE-2(1H)-CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS LYCERA CORPORATION (US) 2019-10-17 — — 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 (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-20210139484-A1 DIHYDROISOQUINOLINE-2(1H)-CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS ULK1, PHKG2, PHKG1 ELANE 2775/4885GPR119 329/4885MAPT 1850/4885

“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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