SCHEMBL7208906

SCHEMBL7208906

COC(=O)CCCCCI.[Zn]

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
LMNA P02545 2/20 0.53
ALDH1A1 P00352 1/20 0.53
KMT2A Q03164 3/20 0.44
RECQL P46063 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
EPHX2 P34913 4/20 0.41
MEN1 O00255 2/20 0.40
POLB P06746 1/20 0.40
POLA1 P09884 1/20 0.40
HPGD P15428 1/20 0.40
CA12 O43570 1/20 0.39
CA14 Q9ULX7 1/20 0.39
DGKA P23743 1/20 0.39

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
SCHEMBL4346958 0.98 TSHR (0.64) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL11857583 0.98 TSHR (0.64) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL28070085 0.98 TSHR (0.64) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL1744907 0.98 TSHR (0.64) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL11865856 0.98 TSHR (0.64) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL9244508 0.98 TSHR (0.64) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL4334523 0.98 TSHR (0.64) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL2428839 0.98 TSHR (0.64) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL11512940 0.98 TSHR (0.64) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL5098798 0.95

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6613932-B1 Prostaglandin derivatives TAISHO PHARMACEUTICAL CO., LTD. (JP) 2003-09-02 US disclosed
EP-1219601-A1 PROSTAGLANDIN DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD (JP) 2002-07-03 EP disclosed