SCHEMBL3592024

SCHEMBL3592024

O=C(O)Cn1ccnc1C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 7/20 0.43
ESR1 P03372 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CSNK2A2 P19784 2/20 0.36
CSNK2A1 P68400 2/20 0.36
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
PTGS2 P35354 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL7426195 0.82 SMN1; SMN2 (0.41) FPR2ESR1SMN1; SMN2CSNK2A2CSNK2A1
SCHEMBL1831519 0.78 FPR2 (0.50) FPR2ALDH1A1KMT2AKDM4E
SCHEMBL27505442 0.76 FPR2 (0.40) FPR2ESR1SMN1; SMN2CSNK2A2CSNK2A1
SCHEMBL28173216 0.75 KMT2A (0.38) FPR2ALDH1A1KMT2A
SCHEMBL26196835 0.74 KDR (0.32) FPR2ALDH1A1KMT2A
SCHEMBL31252039 0.73 TLR8 (0.43) SMN1; SMN2ALDH1A1KMT2AKDM4E
SCHEMBL938206 0.72 ARG1 (0.53) FPR2ESR1SMN1; SMN2CSNK2A2CSNK2A1
SCHEMBL369240 0.72 ALPL (0.54) ESR1SMN1; SMN2ALDH1A1KMT2AKDM4E
SCHEMBL15501010 0.72 CSNK2A2 (0.46) FPR2ESR1SMN1; SMN2CSNK2A2CSNK2A1
SCHEMBL4288735 0.72 FPR2 (0.40) FPR2ESR1SMN1; SMN2CSNK2A2CSNK2A1

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-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2010-11-11 US disclosed
EP-1962605-A2 2-ARYLTHIAZOLE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS Merck & Co., Inc. (US) 2008-09-03 EP disclosed
WO-2007070433-A2 2-ARYLTHIAZOLE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2007-06-21 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-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators CXCR3, CXCR1, CXCR2 FPR2 64/4885ESR1 2000/4885SMN1; SMN2 4711/4885

“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.