SCHEMBL705332

SCHEMBL705332

COC(=O)c1ccc(Cn2ccnc2[C@@H](C)c2cccc(C)c2C)c(OC)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 1/20 0.42
HSP90AA1 P07900 5/20 0.42
HSP90B1 P14625 5/20 0.42
TDP1 Q9NUW8 2/20 0.41
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.37
HDAC6 Q9UBN7 1/20 0.36
P2RX7 Q99572 1/20 0.36
NOX1 Q9Y5S8 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL697926 0.84 RAB9A (0.48) TDP1MAPTL3MBTL1LMNARAB9A
SCHEMBL697166 0.82 TDP1 (0.51) HSP90AA1HSP90B1TDP1MAPTLMNA
SCHEMBL697585 0.75 ADRA2C (0.53) HSP90AA1HSP90B1TDP1LMNAALDH1A1
SCHEMBL696999 0.73 ALDH1A1 (0.37) TDP1MAPTLMNARAB9AALDH1A1
SCHEMBL696319 0.73 TDP1 (0.46) TDP1LMNARAB9AKMT2A
SCHEMBL695870 0.73 PPARG (0.38) TDP1MAPTALDH1A1P2RX7KDM4E
SCHEMBL696898 0.73 KCNH2 (0.38) TDP1MAPTALDH1A1KMT2AP2RX7
SCHEMBL697382 0.73 TDP1 (0.47) TDP1MAPTLMNAALDH1A1KMT2A
SCHEMBL696260 0.73 TDP1 (0.47) TDP1MAPTLMNAALDH1A1KMT2A
SCHEMBL697584 0.73 KCNH2 (0.41) TDP1MAPTALDH1A1KMT2AP2RX7

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 TLR7 1249/4885HSP90AA1 1213/4885HSP90B1 467/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TLR7 1249/4885HSP90AA1 1213/4885HSP90B1 467/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TLR7 1249/4885HSP90AA1 1213/4885HSP90B1 467/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TLR7 1249/4885HSP90AA1 1213/4885HSP90B1 467/4885

“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.