SCHEMBL31145119

SCHEMBL31145119

C[C@@H]1CC[C@@H](c2cc3cn[nH]c3cc2F)NC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 2/20 0.40
▸ ROCK2 O75116 8/20 0.36
▸ TRPA1 O75762 3/20 0.35
▸ CHEK1 O14757 1/20 0.34
▸ ROCK1 Q13464 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ FGFR2 P21802 1/20 0.33
▸ AXL P30530 1/20 0.32
▸ GPER1 Q99527 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ APAF1 O14727 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ MKNK1 Q9BUB5 1/20 0.31

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
SCHEMBL29081399 1.00 MET (0.40) METROCK2TRPA1CHEK1ROCK1
SCHEMBL24364954 0.78 MET (0.39) METROCK2TRPA1CHEK1ROCK1
SCHEMBL25321084 0.76 SLC6A2 (0.42) METROCK2ROCK1KDM4EMEN1
SCHEMBL31145171 0.76 SLC6A2 (0.42) METROCK2ROCK1KDM4EMEN1
SCHEMBL24365829 0.76 SLC6A2 (0.42) METROCK2ROCK1KDM4EMEN1
SCHEMBL24366170 0.76 SLC6A2 (0.42) METROCK2ROCK1KDM4EMEN1
SCHEMBL24364537 0.76 SLC6A2 (0.42) METROCK2ROCK1KDM4EMEN1
SCHEMBL29981069 0.76 SLC6A2 (0.42) FGFR1FGFR2KDM4EMEN1APAF1
SCHEMBL31145067 0.76 SLC6A2 (0.42) FGFR1FGFR2KDM4EMEN1APAF1
SCHEMBL29520830 0.75 TRPA1 (0.50) METROCK2TRPA1CHEK1ROCK1

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-20240279219-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-08-22 — — 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-20240279219-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 MET 2437/4885ROCK2 2430/4885TRPA1 848/4885

“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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