SCHEMBL703524

SCHEMBL703524

Cc1cccc([C@H](C)c2nccn2C(=O)OCC2(C)COC2)c1C

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 2/20 0.32
FFAR1 O14842 1/20 0.32
ACACB O00763 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
TSHR P16473 1/20 0.31
DHFR P00374 1/20 0.30
DCPS Q96C86 1/20 0.30
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL698166 0.91 OPRD1 (0.33) LMNAPOLBALDH1A1MAPTHTT
SCHEMBL696473 0.88 MEN1 (0.33) IRAK4LMNAPOLBALDH1A1MAPT
SCHEMBL699093 0.85 ALDH1A1 (0.40) LMNAPOLBALDH1A1MAPTHTT
SCHEMBL698041 0.82 CYP19A1 (0.36) LMNAPOLBALDH1A1MAPTHTT
SCHEMBL697019 0.82 TSHR (0.40) LMNAPOLBALDH1A1MAPTHTT
SCHEMBL697994 0.82 TSHR (0.40) LMNAPOLBALDH1A1MAPTHTT
SCHEMBL698176 0.81 GRIN2B (0.41) LMNAPOLBFFAR1ALDH1A1MAPT
SCHEMBL697702 0.81 MAPK1 (0.43) LMNAPOLBALDH1A1MAPTHTT
SCHEMBL697568 0.81 MEN1 (0.34) LMNAPOLBALDH1A1MAPTHTT
SCHEMBL697147 0.81 GPR119 (0.36) LMNAPOLBACACBALDH1A1MAPT

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 IRAK4 2308/4885LMNA 3030/4885POLB 3099/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 IRAK4 2308/4885LMNA 3030/4885POLB 3099/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 IRAK4 2308/4885LMNA 3030/4885POLB 3099/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 IRAK4 2308/4885LMNA 3030/4885POLB 3099/4885

“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.