SCHEMBL6725463

SCHEMBL6725463

O=C(O)c1c(Cl)cc(F)c(C(F)(F)F)c1F

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
MRGPRX4 Q96LA9 2/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRB2 P47870 1/20 0.32
GABRA4 P48169 1/20 0.32
GABRE P78334 1/20 0.32
GABRA6 Q16445 1/20 0.32

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
SCHEMBL2926198 0.83 CA1 (0.38) NOTUMTSHRSMN1; SMN2RXRARXRB
SCHEMBL5508917 0.79 CA1 (0.40) DPP4KEAP1NFE2L2POLBAPEX1
SCHEMBL6726442 0.79 SOS1 (0.38) TSHRSMN1; SMN2RXRARXRBRXRG
SCHEMBL2926338 0.76 NOTUM (0.38) DPP4MRGPRX4GABRPGABRDGABRA1
SCHEMBL6728940 0.75 AKR1C2 (0.37) DPP4KEAP1NFE2L2POLBAPEX1
SCHEMBL8926676 0.74 CA1 (0.36) TSHRSMN1; SMN2CA1CA2CA4
SCHEMBL22115216 0.72 SMN1; SMN2 (0.44) TSHRSMN1; SMN2RXRARXRBRXRG
SCHEMBL31446281 0.72 CA1 (0.42) KEAP1NFE2L2NOTUMTSHRSMN1; SMN2
SCHEMBL9769391 0.71 HSD17B10 (0.39) KEAP1TSHRSMN1; SMN2RXRARXRB
SCHEMBL320103 0.71 GABRP (0.48) DPP4TLR7MRGPRX4GABRPGABRD

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 DPP4 4490/4885KEAP1 496/4885NFE2L2 714/4885

“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.