SCHEMBL3974397

SCHEMBL3974397

CC(C)(O)C(=O)c1ccc(OCCCC(O)CN(CCO)CC(O)COCCOc2ccc(C(=O)C(C)(C)O)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
TSHR P16473 1/20 0.38
MAPK1 P28482 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PLA2G4B P0C869 1/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 2/20 0.36
RARB P10826 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.35
THRA P10827 1/20 0.35

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
SCHEMBL3981952 0.93 ALDH1A1 (0.57) ALDH1A1LMNAGAASMN1; SMN2ADRB2
SCHEMBL3975347 0.91 ALDH1A1 (0.47) ALDH1A1LMNAGAASMN1; SMN2ADRB2
SCHEMBL14678938 0.90 ALDH1A1 (0.54) ALDH1A1LMNAGAASMN1; SMN2ADRB2
SCHEMBL15188999 0.86 KDM4E (0.41) ALDH1A1LMNAGAASMN1; SMN2ADRB2
SCHEMBL3979289 0.82 ALDH1A1 (0.55) ALDH1A1LMNAGAASMN1; SMN2ADRB2
SCHEMBL13321395 0.82 KMT2A (0.41) ALDH1A1LMNAGAASMN1; SMN2ADRB2
SCHEMBL13353223 0.82 HTT (0.41) ALDH1A1LMNAGAASMN1; SMN2ADRB2
SCHEMBL13871234 0.81 ALDH1A1 (0.44) ALDH1A1LMNAGAASMN1; SMN2TSHR
SCHEMBL3973210 0.81 KDM4E (0.40) ALDH1A1LMNAGAASMN1; SMN2ADRB2
SCHEMBL4414721 0.81 ALDH1A1 (0.45) ALDH1A1LMNAGAASMN1; SMN2ADRB2

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 302/4885LMNA 843/4885GAA 2304/4885

“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.