SCHEMBL698141

SCHEMBL698141

CCOc1ccc(COC(=O)n2ccnc2[C@@H](C)c2cccc(C)c2C)cc1OCC

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MEN1 O00255 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
S1PR1 P21453 1/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 2/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
ALDH1A1 P00352 3/20 0.35
POLB P06746 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.34
CALM1 P0DP23 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 1/20 0.34
FFAR1 O14842 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL697835 0.95 MAPT (0.41) KMT2AMEN1SMN1; SMN2GAATP53
SCHEMBL698178 0.90 SLC22A12 (0.35) NPSR1TP53MAPTLMNAALDH1A1
SCHEMBL697860 0.89 FFAR1 (0.35) MAPTLMNAPOLBL3MBTL1NPC1
SCHEMBL708924 0.89 FFAR1 (0.38) SMN1; SMN2TP53LMNAALDH1A1MRGPRX4
SCHEMBL3533515 0.88 TP53 (0.40) KMT2AMEN1SMN1; SMN2NPSR1TP53
SCHEMBL699093 0.88 ALDH1A1 (0.40) KMT2AMEN1GAATP53MAPT
SCHEMBL703828 0.87 MEN1 (0.42) KMT2AMEN1SMN1; SMN2MAPTLMNA
SCHEMBL697165 0.87 GRIN2B (0.42) MAPTLMNAALDH1A1POLBFFAR1
SCHEMBL697607 0.87 ALKBH1 (0.36) SMN1; SMN2MAPTLMNAHTTALDH1A1
SCHEMBL698126 0.87 GRIN2B (0.41) KMT2AMEN1SMN1; SMN2MAPTLMNA

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 KMT2A 945/4885MEN1 493/4885SMN1; SMN2 1394/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KMT2A 945/4885MEN1 493/4885SMN1; SMN2 1394/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KMT2A 945/4885MEN1 493/4885SMN1; SMN2 1394/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KMT2A 945/4885MEN1 493/4885SMN1; SMN2 1394/4885

“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.