SCHEMBL10705365

SCHEMBL10705365

COC(=O)CCCCCOC1CCCCO1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
EPHX2 P34913 2/20 0.45
TSHR P16473 1/20 0.40
LMNA P02545 3/20 0.39
NAAA Q02083 2/20 0.39
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
ALOX12 P18054 1/20 0.37
GLA P06280 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL7605558 1.00 KMT2A (0.52) KMT2AMEN1EPHX2TSHRLMNA
SCHEMBL13736496 1.00 KMT2A (0.52) KMT2AMEN1EPHX2TSHRLMNA
SCHEMBL8772693 1.00 KMT2A (0.52) KMT2AMEN1EPHX2TSHRLMNA
SCHEMBL1516089 0.95 KMT2A (0.50) KMT2AMEN1EPHX2TSHRLMNA
SCHEMBL31614996 0.92 MEN1 (0.46) KMT2AMEN1EPHX2LMNAALDH1A1
SCHEMBL19331817 0.92 MEN1 (0.46) KMT2AMEN1EPHX2LMNAALDH1A1
SCHEMBL12221438 0.89 MEN1 (0.46) KMT2AMEN1EPHX2TSHRLMNA
SCHEMBL1263510 0.86 MEN1 (0.50) KMT2AMEN1EPHX2LMNANAAA
SCHEMBL11537124 0.86 MEN1 (0.50) KMT2AMEN1EPHX2LMNANAAA
SCHEMBL9316469 0.85 MEN1 (0.54) KMT2AMEN1LMNANAAAPOLB

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-0156611-B1 INTERMEDIATES FOR THE PREPARATION OF PROSTAGLANDIN ANALOGUES ONO PHARMACEUTICAL CO., LTD. (JP) 1988-06-01 EP disclosed
US-4622410-A CHEMICAL INTERMEDIATES FOR 6-KETO-PROSTAGLANDINS ONO PHARMACEUTICAL CO. LTD. (JP) 1986-11-11 US disclosed
EP-0156611-A2 Intermediates for the preparation of prostaglandin analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1985-10-02 EP disclosed