SCHEMBL3627291

SCHEMBL3627291

CC(=O)N1N=C(c2cccc(Cl)c2Cl)CC1c1c[c]ccc1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 8/20 0.65
▸ AOC1 P19801 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ EGFR P00533 1/20 0.50

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
SCHEMBL3624793 0.91 KIF11 (0.78) KIF11AOC1KDM4EGAAEGFR
SCHEMBL3623088 0.84 KIF11 (0.65) KIF11EGFR
SCHEMBL3613719 0.83 KIF11 (0.85) KIF11AOC1
SCHEMBL3620943 0.82 KIF11 (0.78) KIF11AOC1KDM4EGAA
SCHEMBL3618674 0.80 KIF11 (0.71) KIF11KDM4EGAAEGFR
SCHEMBL3622572 0.80 KIF11 (0.71) KIF11
SCHEMBL3624192 0.77 KIF11 (0.78) KIF11KDM4EGAA
SCHEMBL3622144 0.76 KIF11 (0.58) KIF11EGFR
SCHEMBL4321033 0.76 KIF11 (1.00) KIF11AOC1
SCHEMBL3627575 0.76 KIF11 (1.00) KIF11AOC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050119484-A1 Mitotic kinesin inhibitors MERCK SHARP & DOHME CORP. 2005-06-02 — — US claimed
US-7745639-B2 Mitotic kinesin inhibitors MERCK & CO., INC. (US) 2010-06-29 — — US disclosed
US-20050119484-A1 Mitotic kinesin inhibitors MERCK SHARP & DOHME CORP. 2005-06-02 — — 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-20050119484-A1 Mitotic kinesin inhibitors KIF5B, KIF2C, KIF23 KIF11 8/4885AOC1 4404/4885KDM4E 854/4885

“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.

Send feedback