SCHEMBL2305563

SCHEMBL2305563

CCC(C)P(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TRPA1 O75762 2/20 0.36
TSHR P16473 1/20 0.35
TP53 P04637 1/20 0.35
TAAR1 Q96RJ0 4/20 0.33
SLC6A2 P23975 2/20 0.33
SIGMAR1 Q99720 2/20 0.33
MAOA P21397 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
CYP2A6 P11509 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
KCNN4 O15554 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
SCHEMBL16361534 1.00 LMNA (0.38) LMNACYP3A4TDP1TRPA1TSHR
Hydrochloric Acid SCHEMBL344266 0.88 LMNA (0.31) LMNACYP3A4TDP1TRPA1
Hydrochloric Acid SCHEMBL5764560 0.88 SLC6A2 (0.31) LMNACYP3A4TDP1TRPA1TAAR1
SCHEMBL9308091 0.85 CYP3A4 (0.41) LMNACYP3A4TDP1TRPA1TAAR1
SCHEMBL14067502 0.85 CYP3A4 (0.41) LMNACYP3A4TDP1TRPA1TAAR1
SCHEMBL9309105 0.85 CYP3A4 (0.41) LMNACYP3A4TDP1TRPA1TAAR1
SCHEMBL10549324 0.85
SCHEMBL6543955 0.83 CYP3A4 (0.39) CYP3A4TDP1TRPA1TAAR1SLC6A2
SCHEMBL31589 0.83 CYP3A4 (0.39) CYP3A4TDP1TRPA1TAAR1SLC6A2
SCHEMBL10324073 0.83 CYP3A4 (0.39) CYP3A4TDP1TRPA1TAAR1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108602915-B Cyclic olefin-based copolymer and method for preparing same 株式会社LG化学 2020-09-22 CN claimed
CN-108495873-B Cyclic olefin-based copolymer and method for preparing same 株式会社LG化学 2020-07-03 CN claimed
CN-110981692-A Method and system for co-producing isononyl alcohol and carbon octaalkane 中国科学院兰州化学物理研究所 2020-04-10 CN claimed
CN-108602915-A CYCLIC OLEFIN-BASED COPOLYMER AND METHOD FOR PREPARING SAME 株式会社LG化学 2018-09-28 CN claimed
CN-108495873-A Cyclic olefin-based copolymer and method for preparing same 株式会社LG化学 2018-09-04 CN claimed
EP-1107939-B1 PHOSPHINE LIGAND PROMOTED SYNTHESIS OF TETRAARYLOXYALKANE AND DIARYLCARBONATES GEN ELECTRIC (US) 2003-08-06 EP claimed
JP-2002522517-A 2002-07-23 JP claimed
EP-1015452-A4 OPTIONALLY PROTECTED 3-HYDROXYMETHYL CARBAPENEMS AND SYNTHESIS MERCK & CO INC (US) 2001-07-11 EP claimed
EP-1107939-A1 PHOSPHINE LIGAND PROMOTED SYNTHESIS OF TETRAARYLOXYALKANE AND DIARYLCARBONATES GENERAL ELECTRIC COMPANY (US) 2001-06-20 EP claimed
EP-1015452-A1 OPTIONALLY PROTECTED 3-HYDROXYMETHYL CARBAPENEMS AND SYNTHESIS Merck & Co., Inc. (US) 2000-07-05 EP claimed
WO-2000009466-A1 PHOSPINE LIGAND PROMOTED SYNTHESIS OF TETRAARYLOXYALKANE AND DIARYLCARBONATES GENERAL ELECTRIC COMPANY (US) 2000-02-24 WO claimed
US-5973183-A ADDING SMALL AMOUNTS OF AROMATIC, ALIPHATIC, OR CYCLOALIPHATIC PHOSPHINES TO THE REACTION MIXTURE IMPROVES THE YIELD OF TETRAARYLOXY ALKANE AND DIARYL CARBONATE FROM CUPROUS OXIDE, A HYDROXYAROMATIC, AND CARBON DISULFIDE GENERAL ELECTRIC COMPANY (US) 1999-10-26 US claimed
WO-1999010348-A1 OPTIONALLY PROTECTED 3-HYDROXYMETHYL CARBAPENEMS AND SYNTHESIS MERCK & CO., INC. (US) 1999-03-04 WO claimed
US-RE49036-E1 Method for synthesizing optically active carbonyl compounds BASF SE (DE) 2022-04-19 US disclosed
CN-107250091-B Method for synthesizing optically active carbonyl compound 巴斯夫欧洲公司 2021-05-04 CN disclosed
CN-108602915-B Cyclic olefin-based copolymer and method for preparing same 株式会社LG化学 2020-09-22 CN disclosed
US-6313365-B1 Ruthenium metathesis catalyst and method for producing olefin reaction product by metathesis reaction using the same TAKASAGO INTERNATIONAL CORPORATION (JP) 2001-11-06 US disclosed
US-6175047-B1 A CATALYST MIXTURE INCLUDING A RUTHENIUM COMPOUND, A DIHALOGENO COMPOUND, A TERMINAL ALKYNE; AS A CATALYST FOR A CARBON-CARBON BOND FORMATION REACTION TAKASAGO INTERNATIONAL CORPORATION (JP) 2001-01-16 US disclosed
CN-1267569-A Carbonylation method for epoxide derivate SAMSUNG ELECTRONICS CO LTD (KR) 2000-09-27 CN disclosed
EP-0927577-A1 Ruthenium metathesis catalyst and method for producing olefin reaction product by metathesis reaction using the same Takasago International Corporation (JP) 1999-07-07 EP disclosed