SCHEMBL5196952

SCHEMBL5196952

O=C(OCc1ccccc1)C(=Cc1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AKR1C1 Q04828 1/20 0.56
▸ KMT2A Q03164 5/20 0.54
▸ SLC6A2 P23975 1/20 0.54
▸ SLC6A3 Q01959 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ LMNA P02545 5/20 0.51
▸ MAPT P10636 4/20 0.49
▸ ALDH1A1 P00352 4/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ HPGD P15428 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ NR1H4 Q96RI1 1/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ HCAR2 Q8TDS4 1/20 0.46
▸ TRPA1 O75762 1/20 0.46

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
SCHEMBL28189813 0.85 KMT2A (0.43) AKR1C1KMT2ASLC6A2SLC6A3TDP1
SCHEMBL27916231 0.83 TDP1 (0.58) KMT2ASLC6A2SLC6A3TDP1LMNA
SCHEMBL20377906 0.82 AKR1C1 (0.55) AKR1C1KMT2ASLC6A2SLC6A3TDP1
SCHEMBL24704034 0.82 MEN1 (0.70) AKR1C1KMT2ALMNAMAPTALDH1A1
SCHEMBL7527305 0.82 MEN1 (0.70) AKR1C1KMT2ALMNAMAPTALDH1A1
SCHEMBL648889 0.82 MEN1 (0.70) AKR1C1KMT2ALMNAMAPTALDH1A1
SCHEMBL5311037 0.81 LMNA (0.56) KMT2ASLC6A2SLC6A3TDP1LMNA
SCHEMBL13101768 0.81 AKR1C1 (0.56) AKR1C1KMT2ALMNAMAPTALDH1A1
SCHEMBL16143465 0.79 LMNA (0.42) KMT2ATDP1LMNAMAPTALDH1A1
SCHEMBL10455278 0.79 AKR1C1 (0.54) AKR1C1KMT2ALMNAMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885061-B1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S A (FR) 2002-02-20 — — EP claimed
US-6242099-B1 ENCAPSULATION MERCK S.A. (FR) 2001-06-05 — — US claimed
EP-0885061-A1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S.A. (FR) 1998-12-23 — — EP claimed
WO-1998022210-A1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S.A. (FR) 1998-05-28 — — WO claimed
US-10953256-B2 Composition comprising fluorine-containing ketone SINOCHEM LANTIAN CO., LTD (CN) 2021-03-23 — — US disclosed
CN-107126660-B Composition containing fluoroketone 中化蓝天集团有限公司 2021-02-05 — — CN disclosed
EP-3421105-A1 COMPOSITION COMPRISING FLUORINE-CONTAINING KETONE Sinochem Lantian Co., Ltd. (CN) 2019-01-02 — — EP disclosed
US-20180200553-A1 COMPOSITION COMPRISING FLUORINE-CONTAINING KETONE SINOCHEM LANTIAN CO., LTD (CN) 2018-07-19 — — US disclosed
CN-102381916-B Synthesis method of beta, beta-diaryl alkene UNIV ZHEJIANG 2014-03-12 — — CN disclosed
CN-102381916-A Synthesis method of beta, beta-diaryl alkene UNIV ZHEJIANG 2012-03-21 — — CN disclosed
CN-1972675-A Particles for delivery of active agents IVREA PHARMACEUTICALS INC (US) 2007-05-30 — — CN disclosed
EP-1742612-A2 PARTICLES FOR THE DELIVERY OF ACTIVE AGENTS Ivrea Pharmaceuticals, Inc. (US) 2007-01-17 — — EP disclosed
US-20060141046-A1 Particles for the delivery of active agents IVREA PHARMACEUTICALS, INC. (US) 2006-06-29 — — US disclosed
US-20050281886-A1 Particles for the delivery of active agents IVREA PHARMACEUTICALS, INC. (US) 2005-12-22 — — US disclosed
WO-2005107710-A2 PARTICLES FOR THE DELIVERY OF ACTIVE AGENTS IVREA PHARMACEUTICALS, INC. (US) 2005-11-17 — — WO disclosed
US-20040247632-A1 Chitosan microparticles for the topical delivery of water insoluble active agents IVREA, INC. 2004-12-09 — — US disclosed
EP-0885061-B1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S A (FR) 2002-02-20 — — EP disclosed
US-6242099-B1 ENCAPSULATION MERCK S.A. (FR) 2001-06-05 — — US disclosed
EP-0885061-A1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S.A. (FR) 1998-12-23 — — EP disclosed
WO-1998022210-A1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S.A. (FR) 1998-05-28 — — WO disclosed
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