SCHEMBL15065488

SCHEMBL15065488

CC12CCC(C(S(=O)(=O)[O-])C1=O)C2(C)C.CC12CCC(C(S(=O)(=O)[O-])C1=O)C2(C)C.CC12CCC(C(S(=O)(=O)[O-])C1=O)C2(C)C.[Bi+3]

nearest known ligand 0.38

Known targets — ChEMBL curated mechanism

HRH2

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
CNR2 P34972 2/20 0.33
DPP4 P27487 1/20 0.31
PTPN1 P18031 1/20 0.30

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
SCHEMBL1401234 0.97 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL906300 0.97 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL1305795 0.97 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2HSD17B10MEN1LMNA
Lithium Ion SCHEMBL1458084 0.97 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2HSD17B10MEN1LMNA
Silver SCHEMBL219594 0.97 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL20162191 0.97 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2HSD17B10MEN1LMNA
Potassium Ion SCHEMBL1305480 0.97 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2HSD17B10MEN1LMNA
Tetramethylammonium Ion SCHEMBL593540 0.93 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL6342389 0.93 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL447369 0.84 HSD11B1 (0.31) ALDH1A1SMN1; SMN2HSD17B10MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9527959-B2 Moisture curable organopolysiloxane composition MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2016-12-27 US disclosed
US-9527959-B2 Moisture curable organopolysiloxane composition MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2016-12-27 US disclosed
US-20150005443-A1 MOISTURE CURABLE ORGANOPOLYSILOXANE COMPOSITION MOMENTIVE PERFORMANCE MATERIALS INC. 2015-01-01 US disclosed
US-20150005443-A1 MOISTURE CURABLE ORGANOPOLYSILOXANE COMPOSITION MOMENTIVE PERFORMANCE MATERIALS INC. 2015-01-01 US disclosed
EP-2797692-A1 MOISTURE CURABLE ORGANOPOLYSILOXANE COMPOSITION Momentive Performance Materials Inc. (US) 2014-11-05 EP disclosed
EP-2797692-A1 MOISTURE CURABLE ORGANOPOLYSILOXANE COMPOSITION Momentive Performance Materials Inc. (US) 2014-11-05 EP disclosed
CN-104136118-A MOISTURE CURABLE ORGANOPOLYSILOXANE COMPOSITION MOMENTIVE PERFORMANCE MAT INC 2014-11-05 CN disclosed
WO-2013101755-A1 MOISTURE CURABLE ORGANOPOLYSILOXANE COMPOSITION MOMENTIVE PERFORMANCE MATERIALS, INC. (US) 2013-07-04 WO disclosed
WO-2013101755-A1 MOISTURE CURABLE ORGANOPOLYSILOXANE COMPOSITION MOMENTIVE PERFORMANCE MATERIALS, INC. (US) 2013-07-04 WO disclosed