SCHEMBL18306366

SCHEMBL18306366

Cc1cnc(-c2cccc(F)c2)c(-c2ccc(N)c(C=N)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 2/20 0.36
▸ ADORA2A P29274 4/20 0.36
▸ ADORA1 P30542 4/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ MAP4K4 O95819 3/20 0.36
▸ TAAR1 Q96RJ0 1/20 0.35
▸ CHEK2 O96017 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ GRM5 P41594 1/20 0.34
▸ MTOR P42345 1/20 0.33
▸ MALT1 Q9UDY8 1/20 0.33
▸ ADORA2B P29275 1/20 0.32

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
SCHEMBL18306341 0.90 ADORA1 (0.42) FYNADORA2AADORA1PTGS1PTGS2
SCHEMBL18306300 0.86 USP7 (0.34) PTGS1PTGS2
SCHEMBL18306348 0.85 RPS6KA3 (0.37) PTGS1PTGS2MAP4K4
SCHEMBL18306343 0.84 ABL1 (0.36) FYNGRM5
SCHEMBL17177354 0.84 FYN (0.36) FYNMAP4K4GRM5MALT1
SCHEMBL18306342 0.83 KMT2A (0.40) ADORA2AADORA1MAP4K4
SCHEMBL24716156 0.81 ADORA1 (0.41) FYNADORA2AADORA1MAP4K4MAPT
SCHEMBL18306367 0.78 AURKA (0.37) PTGS1PTGS2MAP4K4
SCHEMBL18306437 0.76 KDM1A (0.46) ADORA1MAP4K4
SCHEMBL18306344 0.76 MAP4K4 (0.37) PTGS1PTGS2MAP4K4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170342048-A1 GDF-8 Inhibitors MIDCAP FINANCIAL TRUST 2017-11-30 — — US disclosed
US-9518040-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2016-12-13 — — 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-20170342048-A1 GDF-8 Inhibitors MSTN, MYOF, CXCL8 FYN 3501/4885ADORA2A 3415/4885ADORA1 1930/4885

“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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