SCHEMBL22492229

SCHEMBL22492229

[CH]1C2=C(CCCC2)c2ccccc21.[Ti]

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
ABCB11 O95342 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
HTR1A P08908 1/20 0.31
CHRM5 P08912 1/20 0.31
ADRA2A P08913 1/20 0.31
CYP2D6 P10635 1/20 0.31
CHRM1 P11229 1/20 0.31
DRD2 P14416 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
CHRM3 P20309 1/20 0.31
DRD1 P21728 1/20 0.31
TBXA2R P21731 1/20 0.31
SLC6A2 P23975 1/20 0.31
HRH2 P25021 1/20 0.31

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
SCHEMBL816449 0.98 TSHR (0.33) TSHRABCB11ALDH1A1TP53CYP1A2
SCHEMBL27786479 0.96 TSHR (0.32) TSHRABCB11ALDH1A1TP53CYP1A2
SCHEMBL22492231 0.90
SCHEMBL5616555 0.85 ALDH1A1 (0.33) TSHRABCB11ALDH1A1TP53CYP1A2
SCHEMBL29264583 0.84 SLC6A2 (0.31) SLC6A2SLC6A4SLC6A3
SCHEMBL7593039 0.72 SETD7 (0.33) TSHRABCB11ALDH1A1TP53CYP1A2
SCHEMBL29133072 0.69 TSHR (0.47) TSHRALDH1A1CHRM2HTR1AADRA2A
SCHEMBL27572786 0.69
SCHEMBL27670655 0.66 ALDH1A1 (0.42) TSHRABCB11ALDH1A1TP53CYP1A2
SCHEMBL5524867 0.63

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
EP-3719042-B1 METHOD FOR PRODUCING STYRENE RESIN AND STYRENE RESIN MOLDED ARTICLE IDEMITSU KOSAN CO (JP) 2026-02-18 EP disclosed
US-12071492-B2 Styrene resin, styrene resin composition, molded article thereof, and styrene resin production method IDEMITSU KOSAN CO., LTD. (JP) 2024-08-27 US disclosed
US-20230056902-A1 STYRENE RESIN, STYRENE RESIN COMPOSITION, MOLDED ARTICLE THEREOF, AND STYRENE RESIN PRODUCTION METHOD IDEMITSU KOSAN CO.,LTD. (JP) 2023-02-23 US disclosed
US-20210371554-A1 STYRENE RESIN, STYRENE RESIN COMPOSITION, MOLDED ARTICLE THEREOF, AND STYRENE RESIN PRODUCTION METHOD IDEMITSU KOSAN CO.,LTD. (JP) 2021-12-02 US disclosed
US-11180584-B2 Method for producing styrene resin and styrene resin molded article IDEMITSU KOSAN CO., LTD. (JP) 2021-11-23 US disclosed
US-20200377629-A1 METHOD FOR PRODUCING STYRENE RESIN AND STYRENE RESIN MOLDED ARTICLE IDEMITSU KOSAN CO.,LTD. (JP) 2020-12-03 US disclosed
EP-3719041-A1 STYRENE RESIN, STYRENE RESIN COMPOSITION, MOLDED ARTICLE THEREOF, AND STYRENE RESIN PRODUCTION METHOD Idemitsu Kosan Co.,Ltd. (JP) 2020-10-07 EP disclosed
EP-3719042-A1 METHOD FOR PRODUCING STYRENE RESIN AND STYRENE RESIN MOLDED ARTICLE Idemitsu Kosan Co.,Ltd. (JP) 2020-10-07 EP disclosed
CN-1419570-A Unbridged monocyclopentadienyl metal complex catalysts with improved tolerance of modified methylaluminoxane UNION CARBIDE CHEM PLASTIC (US) 2003-05-21 CN disclosed