SCHEMBL13034151

SCHEMBL13034151

COc1ccc(COC(C)=O)c(Cl)c1OC

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
SLC2A1 P11166 1/20 0.40
KDM1A O60341 1/20 0.40
MAOB P27338 1/20 0.40
POLB P06746 3/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 2/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
PKM P14618 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PDE4D Q08499 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL13811747 0.85 SLC2A1 (0.38) SMN1; SMN2SLC2A1KDM1AMAOBPOLB
SCHEMBL8728262 0.81 KDM4E (0.39) SMN1; SMN2KDM4EALDH1A1HPGDMAPT
SCHEMBL13034124 0.79 TAAR1 (0.43) SMN1; SMN2POLBKDM4EALDH1A1KMT2A
SCHEMBL14370492 0.78 KDM1A (0.47) SMN1; SMN2SLC2A1KDM1AMAOBPOLB
SCHEMBL13034146 0.78 RXFP1 (0.49) SMN1; SMN2ALDH1A1KMT2AMAPTMEN1
SCHEMBL10622242 0.78 HSD17B10 (0.53) SLC2A1KDM1AMAOBPOLBKDM4E
SCHEMBL698659 0.76 KDM1A (0.46) SMN1; SMN2SLC2A1KDM1AMAOBPOLB
SCHEMBL13034132 0.76 ADRB2 (0.57) SMN1; SMN2POLBALDH1A1KMT2ATP53
SCHEMBL8072931 0.76 SMN1; SMN2 (0.37) SMN1; SMN2POLBKDM4EALDH1A1KMT2A
SCHEMBL3967417 0.75 POLB (0.48) SLC2A1KDM1AMAOBPOLBKDM4E

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 SMN1; SMN2 1394/4885SLC2A1 4021/4885KDM1A 964/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 SMN1; SMN2 1394/4885SLC2A1 4021/4885KDM1A 964/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 SMN1; SMN2 1394/4885SLC2A1 4021/4885KDM1A 964/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 SMN1; SMN2 1394/4885SLC2A1 4021/4885KDM1A 964/4885

“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.