SCHEMBL23326741

SCHEMBL23326741

CC(C)[Si](C(C)C)(C(C)C)n1ccc2c(Oc3ccc4c(c3)C3CCC4CN3C(=O)O)ccnc21

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 12/20 0.33
▸ CAMKK1 Q8N5S9 1/20 0.32
▸ CAMKK2 Q96RR4 1/20 0.32
▸ KDR P35968 3/20 0.31
▸ AURKA O14965 2/20 0.31
▸ TEK Q02763 2/20 0.31
▸ BTK Q06187 1/20 0.30
▸ LCK P06239 2/20 0.30
▸ ABL1 P00519 1/20 0.30
▸ LYN P07948 1/20 0.30
▸ FGR P09769 1/20 0.30
▸ AURKB Q96GD4 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
SCHEMBL23326998 0.89 GHSR (0.31) MET
SCHEMBL23326813 0.79 MET (0.36) METKDRLCK
SCHEMBL23326809 0.77 MET (0.33) METKDRLCK
SCHEMBL23326995 0.76 MET (0.34) MET
SCHEMBL23326690 0.74 HRH3 (0.37) MET
SCHEMBL23327025 0.71 MET (0.32) MET
SCHEMBL23326983 0.70 PTGDR2 (0.42) —
SCHEMBL23327015 0.69 HDAC8 (0.38) —
SCHEMBL21470757 0.68 MET (0.32) MET
SCHEMBL23326759 0.68 MET (0.31) MET

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 MET 1391/4885CAMKK1 8/4885CAMKK2 7/4885

“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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