SCHEMBL24285781

SCHEMBL24285781

Cc1ccc2[nH]ncc2c1C(C)(C)CCS

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.34
▸ AXL P30530 2/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ NOS1 P29475 3/20 0.33
▸ ESR1 P03372 4/20 0.32
▸ ESR2 Q92731 4/20 0.32
▸ CDK2 P24941 1/20 0.31
▸ FLT3 P36888 1/20 0.31
▸ CCNA1 P78396 1/20 0.31
▸ METAP2 P50579 3/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ TRPA1 O75762 2/20 0.31
▸ DHPS P49366 1/20 0.30
▸ TRPM8 Q7Z2W7 1/20 0.30
▸ TRPV1 Q8NER1 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
SCHEMBL21938210 0.84 IDO1 (0.38) IDO1AXLNOS1ESR1ESR2
SCHEMBL17030759 0.79 IDO1 (0.41) IDO1AXLNOS1ESR1ESR2
SCHEMBL18456308 0.74 AXL (0.50) IDO1AXLNOS1ESR1ESR2
SCHEMBL25799613 0.74 NOS1 (0.39) IDO1AXLNOS1ESR1ESR2
SCHEMBL18408609 0.71 — —
SCHEMBL24089316 0.71 — —
SCHEMBL24089313 0.69 — —
SCHEMBL25802935 0.69 IDO1 (0.43) IDO1AXLNOS1ESR1ESR2
SCHEMBL8404436 0.68 IDO1 (0.46) IDO1AXLNOS1ESR1ESR2
SCHEMBL20850537 0.66 CDK2 (0.43) IDO1AXLNOS1ESR1ESR2

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-11279689-B2 1-(3-(6-(3-hydroxynaphthalen-1-yl)benzofuran-2-yl)azetidin-1 yl)prop-2-en-1-one derivatives and similar compounds as KRAS G12C modulators for treating cancer ARAXES PHARMA LLC (US) 2022-03-22 — — 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-11279689-B2 1-(3-(6-(3-hydroxynaphthalen-1-yl)benzofuran-2-yl)azetidin-1 yl)prop-2-en-1-one derivatives and similar compounds as KRAS G12C modulators for treating cancer KRAS, NRAS, HRAS IDO1 1513/4885AXL 3576/4885FGFR1 1636/4885

“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.

Send feedback