SCHEMBL697782

SCHEMBL697782

Cc1cc(C)cc(COC(=O)n2ccnc2[C@@H](C)c2cccc(C)c2C)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.35
TACR1 P25103 5/20 0.34
FFAR1 O14842 3/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.33
PARP10 Q53GL7 1/20 0.32
TP53 P04637 1/20 0.32
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 2/20 0.31
FFAR4 Q5NUL3 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL697165 0.93 GRIN2B (0.42) GRIN2BFFAR1LMNAPOLBALDH1A1
SCHEMBL698126 0.91 GRIN2B (0.41) GRIN2BLMNAALDH1A1KMT2AMEN1
SCHEMBL702018 0.90 FFAR1 (0.35) FFAR1LMNAPOLBTP53KMT2A
SCHEMBL697245 0.90 MMP1 (0.35) GRIN2BFFAR1LMNAPOLBTP53
SCHEMBL697932 0.90 LMNA (0.34) GRIN2BFFAR1LMNAPOLBTP53
SCHEMBL697760 0.89 L3MBTL1 (0.38) GRIN2BFFAR1LMNAALDH1A1KMT2A
SCHEMBL696648 0.89 MAOB (0.34) FFAR1LMNAPOLBTP53ALDH1A1
SCHEMBL697860 0.89 FFAR1 (0.35) GRIN2BFFAR1LMNAPOLB
SCHEMBL697730 0.87 GRM5 (0.41) FFAR1TP53ALDH1A1FFAR4
SCHEMBL697361 0.87 GRIN2B (0.41) GRIN2BFFAR1LMNA

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 GRIN2B 3622/4885TACR1 3326/4885FFAR1 4603/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 GRIN2B 3622/4885TACR1 3326/4885FFAR1 4603/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 GRIN2B 3622/4885TACR1 3326/4885FFAR1 4603/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 GRIN2B 3622/4885TACR1 3326/4885FFAR1 4603/4885

“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.