SCHEMBL4137905

SCHEMBL4137905

NC(=O)Nc1ccc2[nH]c3ccc(C(F)(F)F)cc3c2c1

nearest known ligand 0.90

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 10/20 0.90
KMT2A Q03164 4/20 0.48
KDM4E B2RXH2 2/20 0.48
MTNR1A P48039 2/20 0.48
MTNR1B P49286 2/20 0.48
CHUK O15111 1/20 0.48
PDGFRB P09619 1/20 0.47
KDR P35968 1/20 0.47
MEN1 O00255 2/20 0.47
MAP2K4 P45985 1/20 0.44

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
SCHEMBL4127282 0.95 KIF11 (1.00) KIF11KMT2AKDM4EMTNR1AMTNR1B
SCHEMBL4124681 0.93 KIF11 (0.92) KIF11KMT2ACHUKPDGFRBKDR
SCHEMBL4132335 0.87 KIF11 (1.00) KIF11KMT2A
SCHEMBL4126195 0.81 KIF11 (0.77) KIF11CHUK
SCHEMBL6082253 0.79 AR (0.62) KIF11
SCHEMBL29507666 0.79 KIF11 (0.81) KIF11KMT2AKDM4ECHUKMEN1
SCHEMBL412032 0.79 KIF11 (0.81) KIF11KMT2AKDM4ECHUKMEN1
SCHEMBL167549 0.77 KIF11 (0.89) KIF11
SCHEMBL167618 0.74 KIF11 (0.79) KIF11KMT2AMEN1
Hydrochloric Acid SCHEMBL30543132 0.73 KIF11 (0.77) KIF11KMT2AMEN1

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-20090170882-A1 Methods and compositions CYTOKINETICS, INCORPORATED 2009-07-02 US disclosed
EP-1771176-A2 METHODS AND COMPOSITIONS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-11 EP disclosed
WO-2006005063-A2 METHODS AND COMPOSITIONS SMITHKLINE BEECHAM CORPORATION (US) 2006-01-12 WO 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-20090170882-A1 Methods and compositions KIF5B, KIF5C, KIF2C KIF11 10/4885KMT2A 2096/4885KDM4E 2332/4885

“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.