SCHEMBL20626527

SCHEMBL20626527

CCC(C)(C)CCNc1ccncc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.39
▸ CTSD P07339 1/20 0.37
▸ FDPS P14324 1/20 0.35
▸ ADRA2B P18089 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ GRIN2B Q13224 1/20 0.35
▸ RAB9A P51151 1/20 0.34
▸ LIMK1 P53667 1/20 0.34
▸ TRPA1 O75762 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ LATS1 O95835 1/20 0.33
▸ LATS2 Q9NRM7 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL18922336 0.87 F2 (0.41) F2CTSDFDPSADRA2BKCNH2
SCHEMBL11478052 0.82 CTSD (0.41) F2CTSDFDPSADRA2BRAB9A
SCHEMBL2128107 0.82 F2 (0.41) F2CTSDFDPSADRA2BKCNH2
SCHEMBL20626603 0.81 MAPT (0.50) MAPTL3MBTL1HRH3KMT2A
SCHEMBL20112844 0.77 F2 (0.39) F2CTSDLIMK1TRPA1MAPT
SCHEMBL26941343 0.77 ADRA2B (0.36) F2ADRA2BKCNH2GRIN2BRAB9A
SCHEMBL7054279 0.76 LIMK1 (0.51) F2CTSDFDPSADRA2BKCNH2
SCHEMBL19669165 0.76 F2 (0.40) F2CTSDFDPSADRA2BKCNH2
SCHEMBL2128482 0.72 KDM6B (0.47) F2CTSDLIMK1MAPTLATS1
SCHEMBL19826267 0.71 GAA (0.41) RAB9AMAPT

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-10172858-B2 Combination pharmaceutical compositions and uses thereof INTELLIKINE LLC (US) 2019-01-08 — — 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-10172858-B2 Combination pharmaceutical compositions and uses thereof CDC25C, CCNC, CDC25B F2 4410/4885CTSD 3502/4885FDPS 914/4885

“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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