SCHEMBL4280463

SCHEMBL4280463

[O]C(c1ccccc1)(c1ccccc1)C(c1ccccc1)C([O])(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.42
CYP2D6 P10635 1/20 0.37
SRC P12931 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
TSHR P16473 3/20 0.36
KCNN4 O15554 1/20 0.36
F2 P00734 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 2/20 0.36
MAPK1 P28482 1/20 0.36
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL4274915 0.78 SRC (0.38) DPP4CYP2D6SRCTSHRKCNN4
SCHEMBL6571071 0.75 CES2 (0.35) DPP4CYP2D6SRCTSHRKCNN4
SCHEMBL4277955 0.73 CNR1 (0.34) DPP4CYP2D6SRCKMT2AKCNN4
SCHEMBL4272460 0.73 CES2 (0.34) DPP4CYP2D6SRCTSHRKCNN4
SCHEMBL4068912 0.70 MAPK1 (0.42) MAPTKMT2AKCNN4ALDH1A1MAPK1
SCHEMBL11327689 0.70 CYP2D6 (0.42) CYP2D6MAPTKMT2ATSHRKCNN4
SCHEMBL9669699 0.67 MAPK1 (0.50) MAPTKMT2ATSHRKCNN4ALDH1A1
SCHEMBL4269900 0.66 KCNN4 (0.47) MAPTKMT2ATSHRKCNN4ALDH1A1
SCHEMBL2335365 0.66 KCNN4 (0.47) MAPTKMT2ATSHRKCNN4ALDH1A1
SCHEMBL42163 0.66 KCNN4 (0.47) MAPTKMT2ATSHRKCNN4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615660-B2 Production process of alkoxy-titanium complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-10 US disclosed
US-20080306293-A1 Production Process of Alkoxy-Titanium Complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-12-11 US disclosed
EP-1845101-A1 METHOD FOR PRODUCING ALKOXYTITANIUM COMPLEX Sumitomo Chemical Company, Limited (JP) 2007-10-17 EP 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 (1 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-20080306293-A1 Production Process of Alkoxy-Titanium Complex ABL1, H1-10, ALK DPP4 3939/4885CYP2D6 505/4885SRC 1126/4885

“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.