SCHEMBL8097730

SCHEMBL8097730

Cc1cc(OC2CCN(Cc3ccccc3C(=O)NC(C)C(=O)O)CC2)c2cc(F)ccc2n1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.45
CCR3 P51677 5/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 3/20 0.39
CHRM4 P08173 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HRH1 P35367 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
IDO1 P14902 1/20 0.37
KCNH2 Q12809 1/20 0.37
HTR1A P08908 1/20 0.37
HTR1D P28221 1/20 0.37
HTR1B P28222 1/20 0.37
DRD4 P21917 1/20 0.36

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
SCHEMBL13969213 0.91 GAA (0.42) GAACCR3ATMALDH1A1CHRM4
SCHEMBL13945377 0.88 CCR3 (0.47) CCR3ATMALDH1A1CHRM4MEN1
SCHEMBL8100178 0.86 CHRM4 (0.42) CCR3ATMALDH1A1CHRM4HRH1
SCHEMBL13945459 0.86 ALDH1A1 (0.47) GAACCR3ATMALDH1A1CHRM4
SCHEMBL13945372 0.78 SMN1; SMN2 (0.52) GAAALDH1A1CHRM4HTR1AHTR1D
SCHEMBL8088928 0.78 HRH1 (0.48) CCR3ALDH1A1KMT2AHRH1KCNH2
SCHEMBL4242392 0.78 CHRM4 (0.49) CCR3CHRM4HRH1KCNH2HTR1D
SCHEMBL4245783 0.75 CCR3 (0.45) CCR3MEN1KMT2AHRH1KCNH2
SCHEMBL4249178 0.74 CCR3 (0.42) CCR3MEN1KMT2AHRH1KCNH2
SCHEMBL4242109 0.74 CHRM4 (0.40) CHRM4HTR1AHTR1DHTR1B

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-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2009-01-22 US disclosed
WO-2009000085-A1 QUINOLINE AND QUINAZOLINE DERIVATIVES USEFUL AS MODULATORS OF GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2008-12-31 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-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS TRPV1, TRPV2, TRPA1 GAA 2750/4885CCR3 3169/4885ATM 4607/4885

“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.