SCHEMBL2140221

SCHEMBL2140221

CO[Si]([O])(c1ccccc1)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.36
ALDH1A1 P00352 3/20 0.35
TSHR P16473 2/20 0.35
ALOX15 P16050 1/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
HSD17B10 Q99714 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
KMT2A Q03164 2/20 0.33
CES1 P23141 2/20 0.33
SRC P12931 1/20 0.33
MAPK1 P28482 1/20 0.33
MAPT P10636 1/20 0.33
NR1H2 P55055 2/20 0.32
NR1H3 Q13133 2/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
CES2 O00748 1/20 0.32
CA4 P22748 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL277279 0.73 MAPK1 (0.36) KCNN4ALDH1A1ALOX15ESR1ESR2
SCHEMBL704188 0.73 MAPK1 (0.36) KCNN4ALDH1A1ALOX15ESR1ESR2
SCHEMBL702695 0.73 MAPK1 (0.36) KCNN4ALDH1A1ALOX15ESR1ESR2
SCHEMBL7577311 0.72 CA4 (0.38) KCNN4ALDH1A1TSHRALOX15ESR1
SCHEMBL10438592 0.72 CA4 (0.38) KCNN4ALDH1A1TSHRALOX15ESR1
SCHEMBL152026 0.72 SLC6A2 (0.36) TSHRESR1ESR2KMT2ACES1
SCHEMBL564254 0.72 ESR1 (0.34) ALDH1A1TSHRALOX15ESR1ESR2
SCHEMBL1313821 0.71 ESR1 (0.35) ALDH1A1ALOX15ESR1ESR2MAPK1
SCHEMBL17635119 0.71 ESR1 (0.35) ALDH1A1ALOX15ESR1ESR2MAPK1
SCHEMBL432652 0.70 MAPK1 (0.33) ALDH1A1ALOX15ESR1ESR2MAPK1

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1598334-A1 Thyroid hormone analogues and methods for their preparation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-11-23 EP claimed
EP-1089968-B1 THYROID HORMONE ANALOGUES AND METHODS FOR THEIR PREPARATION UNIV CALIFORNIA (US) 2005-04-20 EP claimed
EP-1089968-A4 THYROID HORMONE ANALOGUES AND METHODS FOR THEIR PREPARATION UNIV CALIFORNIA (US) 2002-08-21 EP claimed
EP-1089968-A1 THYROID HORMONE ANALOGUES AND METHODS FOR THEIR PREPARATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-04-11 EP claimed
US-6107517-A THYROID HORMONE AGONISTS AND ANTAGONISTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-08-22 US claimed
WO-2000000468-A1 THYROID HORMONE ANALOGUES AND METHODS FOR THEIR PREPARATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-01-06 WO claimed
EP-2095875-B1 Homogeneous asymmetric hydrogenation catalyst TAKASAGO PERFUMERY CO LTD (JP) 2014-10-01 EP disclosed
EP-1911516-B1 HOMOGENEOUS ASYMMETRIC HYDROGENATION PROCESS TAKASAGO PERFUMERY CO LTD (JP) 2014-05-14 EP disclosed
EP-2392400-B1 Homogeneous asymmetric hydrogenation method TAKASAGO PERFUMERY CO LTD (JP) 2014-05-07 EP disclosed
US-8586498-B2 Homogeneous asymmetric hydrogenation catalyst TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-11-19 US disclosed
US-8497400-B2 Homogeneous asymmetric hydrogenation process TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-07-30 US disclosed
US-8492390-B2 Synthesis of locked nucleic acid derivatives SANTARIS PHARMA A/S (DK) 2013-07-23 US disclosed
US-8481791-B2 Homogeneous asymmetric hydrogenation process TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-07-09 US disclosed
US-6107517-A THYROID HORMONE AGONISTS AND ANTAGONISTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-08-22 US disclosed
US-6051569-A 1'S, 5R, 6R-carbapenem derivatives and antimicrobial agents comprising the same SUNTORY LIMITED (JP) 2000-04-18 US disclosed
WO-2000000468-A1 THYROID HORMONE ANALOGUES AND METHODS FOR THEIR PREPARATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-01-06 WO disclosed
EP-0826687-A1 Carbapenem derivatives and antimicrobial agents comprising the same SUNTORY LIMITED (JP) 1998-03-04 EP disclosed
EP-0774465-A1 Penem derivatives and antimicrobial agents containing the same SUNTORY LIMITED (JP) 1997-05-21 EP disclosed
EP-0757051-A1 PENEM DERIVATIVES AND ANTIMICROBIAL AGENT CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-02-05 EP disclosed
EP-0638552-A1 PROCESS FOR SYNTHESIZING 4-SUBSTITUTED AZETIDINONE DERIVATIVE SUNTORY LIMITED (JP) 1995-02-15 EP disclosed