SCHEMBL20740992

SCHEMBL20740992

COCCOC(=O)c1ccco1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
KMT2A Q03164 7/20 0.57
TSHR P16473 2/20 0.56
NPC1 O15118 1/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 1/20 0.55
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
MEN1 O00255 2/20 0.50
HTT P42858 1/20 0.50
HSD17B10 Q99714 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
MAPK10 P53779 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL11039202 0.91 ALDH1A1 (0.62) ALDH1A1KMT2ATSHRNPC1LMNA
SCHEMBL1532433 0.84 KMT2A (0.73) ALDH1A1KMT2ATSHRNPC1LMNA
SCHEMBL31337846 0.84 ALDH1A1 (0.59) ALDH1A1KMT2ATSHRNPC1LMNA
SCHEMBL15256939 0.84 ALDH1A1 (0.59) ALDH1A1KMT2ATSHRNPC1LMNA
SCHEMBL1532806 0.83 ALDH1A1 (0.62) ALDH1A1KMT2ATSHRNPC1LMNA
SCHEMBL20348808 0.82 ALDH1A1 (0.49) ALDH1A1KMT2ATSHRNPC1LMNA
SCHEMBL4661575 0.82 ALDH1A1 (0.57) ALDH1A1KMT2ATSHRNPC1LMNA
SCHEMBL3146763 0.82 ALDH1A1 (0.57) ALDH1A1KMT2ATSHRNPC1LMNA
SCHEMBL11523230 0.82 ALDH1A1 (0.55) ALDH1A1KMT2ATSHRNPC1LMNA
SCHEMBL6536291 0.82 ALDH1A1 (0.51) ALDH1A1KMT2ATSHRNPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11292935-B2 Composition for encapsulation and containment of substances Tru BLOC LLC (US) 2022-04-05 US disclosed
US-20200385603-A1 Composition for Encapsulation and Containment of Substances Tru BLOC LLC (US) 2020-12-10 US disclosed
US-10752800-B2 Composition for encapsulation and containment of substances Tru BLOC LLC (US) 2020-08-25 US disclosed
US-20190055424-A1 Composition for Encapsulation and Containment of Substances Tru BLOC LLC (US) 2019-02-21 US disclosed
WO-2019036248-A1 COMPOSITION FOR ENCAPSULATION AND CONTAINMENT OF SUBSTANCES Tru BLOC LLC (US) 2019-02-21 WO disclosed