SCHEMBL11277784

SCHEMBL11277784

CCC(CO)(CO)COCCCCCCO

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41
CES1 P23141 1/20 0.39
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
LMNA P02545 2/20 0.36
TSHR P16473 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GAA P10253 1/20 0.34
GBA2 Q9HCG7 2/20 0.33
ACHE P22303 6/20 0.33
USP2 O75604 1/20 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
SCHEMBL11284350 1.00 THRB (0.41) THRBMEN1KMT2AHTTMAPT
SCHEMBL8087527 0.98 CYP4F2 (0.39) THRBMEN1KMT2AHTTMAPT
SCHEMBL8966981 0.92 TSHR (0.38) THRBMEN1KMT2AHTTMAPT
SCHEMBL14781393 0.90 THRB (0.43) THRBMEN1KMT2AHTTMAPT
SCHEMBL8110696 0.88 CES1 (0.52) THRBMEN1KMT2AHTTMAPT
SCHEMBL7092143 0.88 CES1 (0.52) THRBMEN1KMT2AHTTMAPT
SCHEMBL9547483 0.88 CES1 (0.52) THRBMEN1KMT2AHTTMAPT
SCHEMBL8110171 0.88 CES1 (0.52) THRBMEN1KMT2AHTTMAPT
SCHEMBL1072081 0.86 CES1 (0.48) THRBMEN1KMT2AHTTMAPT
SCHEMBL3785839 0.85 MEN1 (0.45) THRBMEN1KMT2AHTTMAPT

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
EP-0022571-B1 PHOTOSENSITIVE MIXTURE AND METHOD OF PRODUCTION OF RELIEF IMAGES HOECHST AKTIENGESELLSCHAFT (DE) 1982-12-22 EP disclosed
US-4311782-A POLYETHER OF ORTHOCARBOXYLIC ESTER HOECHST AKTIENGESELLSCHAFT (DE) 1982-01-19 US disclosed
EP-0022571-A1 Photosensitive mixture and method of production of relief images HOECHST AKTIENGESELLSCHAFT (DE) 1981-01-21 EP disclosed