SCHEMBL702874

SCHEMBL702874

CC(c1ccccc1C(F)(F)F)c1nccn1COC(=O)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
SSTR1 P30872 2/20 0.35
SSTR4 P31391 2/20 0.35
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TP53 P04637 1/20 0.34
P2RX7 Q99572 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90B1 P14625 1/20 0.34
FPR2 P25090 4/20 0.33
NPC1 O15118 1/20 0.33
CNR2 P34972 1/20 0.33
HSD11B1 P28845 1/20 0.32

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
SCHEMBL697282 0.91 P2RX7 (0.40) KMT2ASSTR1SSTR4ALDH1A1MAPT
SCHEMBL698624 0.83 ALDH1A1 (0.35) KMT2AALDH1A1MAPTTDP1TP53
SCHEMBL697152 0.83 ALDH1A1 (0.35) KMT2AALDH1A1MAPTTDP1TP53
SCHEMBL3528743 0.83 ALDH1A1 (0.35) KMT2AALDH1A1MAPTTDP1TP53
SCHEMBL698829 0.82 NPC1 (0.39) KMT2ATDP1NPC1
SCHEMBL697329 0.80 ALDH1A1 (0.45) KMT2AALDH1A1MAPTTDP1FPR2
SCHEMBL697034 0.79 ALDH1A1 (0.35) KMT2AALDH1A1MAPTTDP1FPR2
SCHEMBL1573126 0.79 ALDH1A1 (0.40) ALDH1A1FPR2NPC1
SCHEMBL697333 0.78 KMT2A (0.36) KMT2AALDH1A1MAPTFPR2NPC1
SCHEMBL696990 0.77 SMN1; SMN2 (0.35) KMT2AALDH1A1TDP1FPR2NPC1

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 945/4885SSTR1 2783/4885SSTR4 2427/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KMT2A 945/4885SSTR1 2783/4885SSTR4 2427/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KMT2A 945/4885SSTR1 2783/4885SSTR4 2427/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KMT2A 945/4885SSTR1 2783/4885SSTR4 2427/4885

“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.