SCHEMBL23326974

SCHEMBL23326974

Cn1cc(-c2cc3c(Nc4ccc5c(c4)CN(C(=O)O)CC5)c(F)cnc3[nH]2)cn1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MERTK Q12866 6/20 0.47
▸ TYRO3 Q06418 6/20 0.47
▸ AXL P30530 3/20 0.47
▸ KIT P10721 8/20 0.46
▸ JAK2 O60674 1/20 0.41
▸ FLT3 P36888 1/20 0.41
▸ BRD4 O60885 2/20 0.39
▸ CREBBP Q92793 2/20 0.39
▸ PDGFRB P09619 1/20 0.39
▸ KDR P35968 1/20 0.39
▸ AURKB Q96GD4 1/20 0.39
▸ GSK3B P49841 2/20 0.39
▸ DYRK1A Q13627 2/20 0.39
▸ WNT1 P04628 1/20 0.39

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
SCHEMBL21470578 0.89 MERTK (0.45) MERTKTYRO3AXLKITJAK2
SCHEMBL23326985 0.83 KIT (0.42) MERTKTYRO3AXLKITPDGFRB
SCHEMBL21470586 0.81 TYRO3 (0.56) MERTKTYRO3AXL
SCHEMBL21470546 0.81 KIT (0.47) KITFLT3
SCHEMBL21471129 0.81 KIT (0.44) MERTKTYRO3AXLKITGSK3B
SCHEMBL23327067 0.78 MERTK (0.42) MERTKTYRO3AXLJAK2FLT3
SCHEMBL23353828 0.78 TYRO3 (0.40) MERTKTYRO3AXLKITJAK2
SCHEMBL21470706 0.73 NR1H2 (0.42) MERTKTYRO3AXLKITPDGFRB
SCHEMBL21471130 0.73 KIT (0.47) KITFLT3PDGFRBKDR
SCHEMBL21471131 0.71 KIT (0.41) KITGSK3BDYRK1A

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 MERTK 1945/4885TYRO3 4131/4885AXL 4579/4885

“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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