SCHEMBL698596

SCHEMBL698596

Cc1cccc([C@H](C)c2nccn2C(=O)OCc2cc(F)ccc2F)c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.38
MMP12 P39900 2/20 0.38
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
FFAR1 O14842 2/20 0.34
PTGDR2 Q9Y5Y4 2/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
POLB P06746 1/20 0.33
PTGER1 P34995 2/20 0.33
ALKBH1 Q13686 1/20 0.32
RAB9A P51151 2/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
SLC6A4 P31645 1/20 0.32
MAPK14 Q16539 1/20 0.32
GRIN2B Q13224 1/20 0.32
IDH1 O75874 2/20 0.32
NPC1 O15118 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
SCHEMBL696841 0.93 FFAR1 (0.37) FFAR1ALDH1A1MAPK1L3MBTL1POLB
SCHEMBL697262 0.93 LMNA (0.32) FFAR1ALDH1A1L3MBTL1POLBRAB9A
SCHEMBL697431 0.93 MAPK14 (0.39) FFAR1ALDH1A1MAPK1L3MBTL1PTGER1
SCHEMBL698747 0.90 MTNR1B (0.37) FFAR1
SCHEMBL713262 0.90 KDM5A (0.36) FFAR1ALDH1A1MAPK1L3MBTL1POLB
SCHEMBL713263 0.90 KDM5A (0.36) FFAR1ALDH1A1MAPK1L3MBTL1POLB
SCHEMBL699023 0.90 ALDH1A1 (0.31) FFAR1ALDH1A1MAPK1L3MBTL1POLB
SCHEMBL698235 0.90 LMNA (0.32) MMP2MMP12MMP1MMP9FFAR1
SCHEMBL702153 0.89 GRIN2B (0.39) MMP2MMP12MMP1MMP9ALDH1A1
SCHEMBL700359 0.89 L3MBTL1 (0.45) ALDH1A1L3MBTL1POLBPTGER1

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 MMP2 3529/4885MMP12 2448/4885MMP1 2571/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 MMP2 3529/4885MMP12 2448/4885MMP1 2571/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 MMP2 3529/4885MMP12 2448/4885MMP1 2571/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 MMP2 3529/4885MMP12 2448/4885MMP1 2571/4885

“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.