SCHEMBL3638375

SCHEMBL3638375

Cc1[nH]c2c(F)ccc(F)c2c1CC(N)=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 3/20 0.37
MAPT P10636 3/20 0.37
GAA P10253 2/20 0.37
SIRT1 Q96EB6 4/20 0.35
POLB P06746 1/20 0.34
BTK Q06187 5/20 0.34
ANO1 Q5XXA6 1/20 0.34
ADRA2A P08913 1/20 0.33
CLCN2 P51788 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33

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
SCHEMBL3639386 0.91 CYP1A2 (0.57) CYP1A2CYP3A4CYP2C19MEN1KMT2A
SCHEMBL3639755 0.88 CYP1A2 (0.41) CYP1A2CYP3A4CYP2C19MEN1KMT2A
SCHEMBL3642948 0.86 SMN1; SMN2 (0.40) CYP1A2CYP3A4CYP2C19MEN1KMT2A
SCHEMBL3636076 0.79 KDM4E (0.55) CYP1A2CYP3A4CYP2C19MEN1KMT2A
SCHEMBL3261669 0.79 KDM4E (0.44) CYP1A2CYP3A4CYP2C19MEN1KMT2A
SCHEMBL4744827 0.78 CYP1A2 (0.73) CYP1A2CYP3A4CYP2C19MEN1KMT2A
SCHEMBL3638377 0.77 KRAS (0.51) CYP1A2CYP3A4CYP2C19MEN1KMT2A
SCHEMBL3379855 0.75 MAP2 (0.47) MEN1KMT2AKDM4EMAPTGAA
SCHEMBL3638399 0.75 CYP1A2 (0.40) CYP1A2CYP3A4CYP2C19SIRT1BTK
SCHEMBL3263047 0.74 MAPT (0.39) CYP1A2CYP3A4CYP2C19MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167077-A2 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR Bayer Schering Pharma Aktiengesellschaft (DE) 2010-03-31 EP claimed
US-20090023741-A1 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AG (DE) 2009-01-22 US claimed
WO-2008152099-A2 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 WO claimed
EP-2002834-A1 Aryl and hetaryl amides as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2008-12-17 EP claimed
EP-2167077-A2 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR Bayer Schering Pharma Aktiengesellschaft (DE) 2010-03-31 EP disclosed
US-20090023741-A1 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AG (DE) 2009-01-22 US disclosed
WO-2008152099-A2 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 WO disclosed
EP-2002834-A1 Aryl and hetaryl amides as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2008-12-17 EP 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-20090023741-A1 ARYL/HETARYLAMIDES AS MODULATORS OF THE EP2 RECEPTOR PTGER2, PTGER1, PTGDR2 CYP1A2 26/4885CYP3A4 245/4885CYP2C19 106/4885

“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.