SCHEMBL5997079

SCHEMBL5997079

CCN(N1CCCC1)S(=O)(=O)c1ccc(Nc2ncc(NC(=O)c3c(C)cccc3C)cn2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 7/20 0.44
▸ MAPK14 Q16539 6/20 0.44
▸ KDR P35968 4/20 0.41
▸ POLB P06746 2/20 0.39
▸ BLK P51451 1/20 0.39
▸ BTK Q06187 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SCN10A Q9Y5Y9 1/20 0.38
▸ KIT P10721 1/20 0.38
▸ SRC P12931 2/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ FYN P06241 1/20 0.38
▸ CSF1R P07333 1/20 0.38
▸ LYN P07948 1/20 0.38
▸ MAPK9 P45984 1/20 0.38
▸ TEK Q02763 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ TSHR P16473 1/20 0.37

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
SCHEMBL5998288 0.90 LCK (0.56) LCKMAPK14POLBNPC1HPGD
SCHEMBL5997433 0.81 LCK (0.45) LCKMAPK14KDRBLKBTK
SCHEMBL5996242 0.80 ALDH1A1 (0.48) LCKMAPK14KDRPOLBNPC1
SCHEMBL5997067 0.78 SRC (0.55) SRCABL1
SCHEMBL5997326 0.78 KMT2A (0.46) LCKMAPK14KDRPOLBNPC1
SCHEMBL2498339 0.77 BTK (0.61) LCKMAPK14KDRBLKBTK
SCHEMBL2498501 0.76 CA1 (0.39) KDRBTKSRCABL1
SCHEMBL5997421 0.74 SRC (0.57) LCKMAPK14POLBKITSRC
SCHEMBL5998386 0.74 JAK2 (0.59) LCKKDRBLKBTKKIT
SCHEMBL5994719 0.73 KIT (0.49) LCKBLKBTKRAB9AKIT

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-20060247250-A1 Pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2006-11-02 — — 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-20060247250-A1 Pyrimidine inhibitors of kinases DTYMK, SRC, DCK LCK 4/4885MAPK14 401/4885KDR 348/4885

“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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