SCHEMBL708924

SCHEMBL708924

CCOc1cccc(COC(=O)n2ccnc2[C@@H](C)c2cccc(C)c2C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.38
MAPK1 P28482 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ROCK2 O75116 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
ROCK1 Q13464 1/20 0.36
TP53 P04637 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
PKM P14618 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
LMNA P02545 2/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 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
SCHEMBL699122 0.92 FFAR1 (0.41) FFAR1MRGPRX4LMNAOPRD1OPRK1
SCHEMBL712178 0.91 FFAR1 (0.41) FFAR1L3MBTL1TDP1LMNAOPRK1
SCHEMBL3533515 0.90 TP53 (0.40) FFAR1MAPK1L3MBTL1TSHRTDP1
SCHEMBL697165 0.89 GRIN2B (0.42) FFAR1LMNAALDH1A1KDM4E
SCHEMBL698141 0.89 KMT2A (0.38) FFAR1MAPK1L3MBTL1TP53SMN1; SMN2
SCHEMBL697760 0.88 L3MBTL1 (0.38) FFAR1L3MBTL1TDP1LMNAOPRD1
SCHEMBL699093 0.88 ALDH1A1 (0.40) MAPK1TSHRCYP3A4CYP2D6CYP2C9
SCHEMBL697730 0.87 GRM5 (0.41) FFAR1TP53ALDH1A1
SCHEMBL697361 0.87 GRIN2B (0.41) FFAR1MAPK1CYP2D6CYP2C9LMNA
SCHEMBL697860 0.87 FFAR1 (0.35) FFAR1L3MBTL1LMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed
US-7825149-B2 Substituted imidazoles PFIZER LIMITED (GB) 2010-11-02 US disclosed
US-20090312326-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2009-12-17 US disclosed
US-7592362-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-09-22 US disclosed
US-7547718-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-16 US disclosed
US-7544706-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-09 US disclosed
US-20080125473-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-29 US disclosed
US-20080119536-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-22 US disclosed
US-20070167506-A1 SUBSTITUTED IMIDAZOLES PFIZER INC. (US) 2007-07-19 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 (4 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-20080125473-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 FFAR1 4603/4885MAPK1 3695/4885L3MBTL1 1548/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 FFAR1 4603/4885MAPK1 3695/4885L3MBTL1 1548/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 FFAR1 4603/4885MAPK1 3695/4885L3MBTL1 1548/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 FFAR1 4603/4885MAPK1 3695/4885L3MBTL1 1548/4885

“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.