SCHEMBL6725150

SCHEMBL6725150

O=Cc1c(Br)cc(F)c(C(F)(F)F)c1F

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.33
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
KIF11 P52732 1/20 0.31

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
SCHEMBL9341658 0.82 CYP2D6 (0.36) CYP2D6CYP2C9KIF11
SCHEMBL5420882 0.78 CA1 (0.37)
SCHEMBL30975518 0.78 CA1 (0.37)
SCHEMBL6731777 0.78 MEN1 (0.33) CYP2D6CYP2C9KIF11
SCHEMBL6725109 0.74
SCHEMBL31422660 0.73 ERN1 (0.42)
SCHEMBL27097096 0.72 CYP2D6 (0.35) CYP2D6CYP2C9KIF11
SCHEMBL20817245 0.71 SOS1 (0.31) SOS1
SCHEMBL7932559 0.71 CA1 (0.34) CYP2D6CYP2C9KIF11
SCHEMBL22122630 0.71 CYP3A4 (0.36) SOS1

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-6677479-B2 REACTING A HALOGENATED BENZENE COMPOUND WITH ALDEHYDE; SOLVENT EXTRACTION; PURIFICATION CLARIANT FINANCE LBVI LIMITED (VG) 2004-01-13 US disclosed
US-20030092930-A1 Substituted fluoroaromatics, process for preparing them and their use CLARIANT GMBH 2003-05-15 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-20030092930-A1 Substituted fluoroaromatics, process for preparing them and their use CYP2F1, CYP1A1, CYP4X1 SOS1 1171/4885CYP2D6 24/4885CYP2C9 15/4885

“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.