SCHEMBL23326761

SCHEMBL23326761

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

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.35
▸ OGA O60502 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ KDM1A O60341 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PTGDR2 Q9Y5Y4 1/20 0.31
▸ MAPT P10636 2/20 0.30
▸ GPR119 Q8TDV5 1/20 0.30
▸ RORC P51449 2/20 0.30
▸ CA2 P00918 1/20 0.30
▸ FNTA P49354 1/20 0.30
▸ FNTB P49356 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
SCHEMBL21470958 0.91 ELANE (0.35) ELANEOGAKDM1ASMN1; SMN2MAPT
SCHEMBL23327000 0.76 KDM4E (0.36) KDM4ESMN1; SMN2PTGDR2
SCHEMBL23327016 0.76 ELANE (0.35) ELANEOGAKDM1AGPR119RORC
SCHEMBL21470756 0.75 ESR2 (0.38) SMN1; SMN2MAPTGPR119
SCHEMBL31569021 0.69 GPR119 (0.39) MAPTGPR119
SCHEMBL31569123 0.69 GPR119 (0.39) MAPTGPR119
SCHEMBL21470478 0.69 HDAC8 (0.38) ELANEGPR119
SCHEMBL31505358 0.69 GHSR (0.45) ELANESMN1; SMN2
SCHEMBL23794824 0.68 SMN1; SMN2 (0.37) KDM4ESMN1; SMN2PTGDR2
SCHEMBL23794831 0.68 SMN1; SMN2 (0.37) KDM4ESMN1; SMN2PTGDR2

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-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

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 2775/4885OGA 1356/4885KDM4E 1512/4885

“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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