SCHEMBL3975010

SCHEMBL3975010

CCO[Si](CCCN(CC(O)CCCOc1ccc(C(=O)C(C)(C)O)cc1)CC(O)COCCc1ccc(C(=O)C(C)(C)O)cc1)(OCC)OCC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
LMNA P02545 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HTT P42858 1/20 0.33
PLA2G4B P0C869 1/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 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
SCHEMBL13871224 0.93 ALDH1A1 (0.33) ALDH1A1MAPTCYP1A2CYP2D6CYP2C9
SCHEMBL3973210 0.90 KDM4E (0.40) ALDH1A1MAPTCYP1A2CYP2D6CYP2C9
SCHEMBL9906982 0.88 KDM4E (0.41) ALDH1A1ADRB2ADRB1ADRB3LMNA
SCHEMBL13871220 0.82 ALDH1A1 (0.35) ALDH1A1MAPTCYP1A2CYP2D6CYP2C9
SCHEMBL3974397 0.79 ALDH1A1 (0.49) ALDH1A1MAPTCYP1A2CYP2D6CYP2C9
SCHEMBL3981982 0.77 MEN1 (0.38) ALDH1A1ADRB2ADRB1ADRB3LMNA
SCHEMBL13871234 0.77 ALDH1A1 (0.44) ALDH1A1MAPTCYP1A2CYP2D6CYP2C9
SCHEMBL3977624 0.76 ALDH1A1 (0.35) ALDH1A1MAPTCYP1A2CYP2D6CYP2C9
SCHEMBL3975347 0.76 ALDH1A1 (0.47) ALDH1A1MAPTCYP1A2CYP2D6CYP2C9
SCHEMBL8673385 0.75 POLB (0.44) LMNAPLA2G4BNPC1RAB9ASMN1; SMN2

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-8367743-B2 Adhesion promoting photoinitiators for UV cured coatings over metal surfaces BASF SE (DE) 2013-02-05 US disclosed
US-20090104464-A1 Adhesion promoting photoinitiators for UV cured coatings over metal surfaces IGM GROUP B.V. (NL) 2009-04-23 US disclosed
WO-2009050116-A2 ADHESION PROMOTING PHOTOINITIATORS FOR UV CURED COATINGS OVER METAL SURFACES BASF SE (DE) 2009-04-23 WO 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-20090104464-A1 Adhesion promoting photoinitiators for UV cured coatings over metal surfaces CDH1, PCNA, VCAM1 ALDH1A1 302/4885MAPT 361/4885CYP1A2 2777/4885

“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.