SCHEMBL696473

SCHEMBL696473

Cc1cccc([C@H](C)c2nccn2C(=O)OCC2(C)CCCCC2)c1C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
THRB P10828 2/20 0.32
OPRD1 P41143 2/20 0.32
OPRK1 P41145 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
POLB P06746 1/20 0.30
IRAK4 Q9NWZ3 1/20 0.30
ATM Q13315 1/20 0.30
CCR5 P51681 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 0.95 OPRD1 (0.33) MEN1KMT2AOPRD1OPRK1ALDH1A1
SCHEMBL703524 0.88 IRAK4 (0.33) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL699093 0.85 ALDH1A1 (0.40) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL697307 0.83 CTSK (0.35) MEN1KMT2AOPRD1OPRK1ALDH1A1
SCHEMBL698041 0.82 CYP19A1 (0.36) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL698409 0.82 GUCY1B2 (0.37) MEN1KMT2AOPRD1LMNATSHR
SCHEMBL697019 0.82 TSHR (0.40) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL697994 0.82 TSHR (0.40) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL697702 0.81 MAPK1 (0.43) MEN1KMT2AOPRD1ALDH1A1MAPT
SCHEMBL698544 0.81 JMJD6 (0.37) MEN1KMT2AOPRD1ALDH1A1MAPT

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 MEN1 493/4885KMT2A 945/4885THRB 2959/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 MEN1 493/4885KMT2A 945/4885THRB 2959/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 MEN1 493/4885KMT2A 945/4885THRB 2959/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 MEN1 493/4885KMT2A 945/4885THRB 2959/4885

“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.