SCHEMBL2114228

SCHEMBL2114228

Cc1c(C(=O)O)c(C)n(C(C(N)=O)N2CCCC2)c1C=C1C(=O)Nc2ccc(S(=O)(=O)N(C)C)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 5/20 0.45
▸ AURKB Q96GD4 3/20 0.45
▸ FYN P06241 3/20 0.45
▸ YES1 P07947 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ RECQL P46063 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ ALK Q9UM73 2/20 0.45
▸ RGS12 O14924 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ GMNN O75496 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ LYN P07948 1/20 0.45
▸ RET P07949 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45

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
SCHEMBL2114496 0.85 LRRK2 (0.42) SRCALKRETFLT3FGFR1
SCHEMBL2117957 0.85 MEN1 (0.46) SRCMEN1KMT2AALKRET
SCHEMBL1673441 0.85 ALK (0.52) SRCAURKBFYNYES1MEN1
SCHEMBL2115792 0.83 NTRK1 (0.43) SRCAURKBFYNYES1MEN1
SCHEMBL2115620 0.83 MGAT2 (0.41) SRCAURKBFYNYES1MEN1
SCHEMBL2116512 0.82 PRKDC (0.39) SRCAURKBFYNYES1MEN1
SCHEMBL2114212 0.81 KDR (0.44) SRCFLT3CDK2FGFR1KDR
SCHEMBL6727036 0.78 KDR (0.53) SRCAURKBFYNYES1MEN1
SCHEMBL2114657 0.78 CHEK1 (0.41) SRCFGFR1KDRPDGFRBEGFR
SCHEMBL2114981 0.77 CHEK1 (0.40) SRCFLT3FGFR1KDRPDGFRB

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-20120094998-A1 Oligomer-Protein Tyrosine Kinase Inhibitor Conjugates NEKTAR THERAPEUTICS (US) 2012-04-19 — — US disclosed
EP-1255752-B1 PYRROLE SUBSTITUTED 2-INDOLINONE PROTEIN KINASE INHIBITORS SUGEN INC (US) 2007-08-08 — — EP 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-20120094998-A1 Oligomer-Protein Tyrosine Kinase Inhibitor Conjugates PTK2B, ERBB2, FRK SRC 18/4885AURKB 210/4885FYN 49/4885

“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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