SCHEMBL5725490

SCHEMBL5725490

OC(c1ccc(OCCn2ccnc2)cc1)(c1cccc(OC2CCCCO2)c1)C(CCOC1CCCCO1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 8/20 0.41
NOS1 P29475 3/20 0.39
LTA4H P09960 1/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 2/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL5725731 0.81 MEN1 (0.39) KMT2AMEN1
SCHEMBL9860239 0.79 MEN1 (0.43) KMT2AMEN1
SCHEMBL5725870 0.77 TBXAS1 (0.49) TBXAS1LTA4HKMT2AMEN1LMNA
SCHEMBL5726588 0.77 MEN1 (0.41) LTA4HKMT2AALDH1A1KDM4EMEN1
SCHEMBL5726536 0.77 DHFR (0.39) KMT2AMEN1
SCHEMBL5726456 0.77 KMT2A (0.40) KMT2AALDH1A1KDM4EMEN1SMN1; SMN2
SCHEMBL9860185 0.77 MEN1 (0.46) KMT2AMEN1
SCHEMBL5738626 0.77 KMT2A (0.44) LTA4HKMT2AALDH1A1KDM4EMEN1
SCHEMBL10923422 0.75 MEN1 (0.47) KMT2AMEN1
SCHEMBL9782612 0.75 KMT2A (0.39) LTA4HKMT2AALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1705169-A2 Triphenylalkene derivatives and their use as selective estrogen receptor modulators Hormos Medical Ltd. (FI) 2006-09-27 EP disclosed
EP-1235776-B1 TRIPHENYLALKENE DERIVATIVES AND THEIR USE AS SELECTIVE ESTROGEN RECEPTOR MODULATORS HORMOS MEDICAL CORP (FI) 2006-02-08 EP disclosed
US-6875775-B2 Triphenylalkene derivatives and their use as selective estrogen receptor modulators HORMOS MEDICAL OY LTD (FI) 2005-04-05 US disclosed
US-6576645-B1 Such as 3-(4-chloro-1-(4-(2-(2-hydroxyethoxy)ethoxy)phenyl)--2-phenylbut-1 -enyl)phenol; producing tissue specific estro-genic and/or antiestrogenic effect HORMOS MEDICAL OY LTD (FI) 2003-06-10 US disclosed