SCHEMBL9986249

SCHEMBL9986249

NC(=O)OCc1ccc2c(c1)-c1ccccc1C2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.49
HTR2B P41595 2/20 0.49
DRD2 P14416 1/20 0.49
ADRA1D P25100 1/20 0.49
HTR2A P28223 1/20 0.49
HTR7 P34969 1/20 0.49
ADRA1A P35348 1/20 0.49
ADRA1B P35368 1/20 0.49
SRD5A2 P31213 1/20 0.45
GABRP O00591 1/20 0.44
GABRD O14764 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRB1 P18505 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
GABRA2 P47869 1/20 0.44
GABRB2 P47870 1/20 0.44
GABRA4 P48169 1/20 0.44

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
SCHEMBL9986247 0.85 SRD5A2 (0.45) HTR2CHTR2BDRD2ADRA1DHTR2A
SCHEMBL7384746 0.79 ALDH1A1 (0.51) HTR2CHTR2BDRD2ADRA1DHTR2A
SCHEMBL15084997 0.77 MAPT (0.53) HTR2BHTR7RAB9ANPC1MAPT
Fluorene SCHEMBL2673075 0.76 GABRP (0.56) HTR2CHTR2BDRD2ADRA1DHTR2A
SCHEMBL8541015 0.76 PPARG (0.51) SRD5A2RAB9ANPC1ALDH1A1HPGD
SCHEMBL1307495 0.76 ALDH1A1 (0.41) HTR2CHTR2BDRD2ADRA1DHTR2A
SCHEMBL1310566 0.76 GPR84 (0.44) HTR2CHTR2BDRD2ADRA1DHTR2A
SCHEMBL3452644 0.75 SRD5A2 (0.54) HTR2CHTR2BSRD5A2ALDH1A1KDM4E
SCHEMBL7342872 0.75 RAB9A (0.44) HTR2CHTR2BDRD2ADRA1DHTR2A
SCHEMBL29699123 0.74 SRD5A2 (0.50) HTR2CHTR2BDRD2ADRA1DHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105640882-A Cabazitaxel micelle drug loading system and preparation method and application thereof 姚俊华 2016-06-08 CN claimed
CN-105399931-A Amphiphilic block copolymer and preparation method and application thereof YAO JUNHUA 2016-03-16 CN claimed
CN-105399938-A Preparation method and application of amphiphilic block copolymer and micelle thereof YAO JUNHUA 2016-03-16 CN claimed
CN-105395481-A Curcumin-containing polymer micelle drug delivery system and preparation method and application thereof YAO JUNHUA 2016-03-16 CN claimed
CN-105310981-A Docetaxel micelle drug loading system and preparation method and application thereof YAO JUNHUA 2016-02-10 CN claimed
CN-105287377-A Paclitaxel polymer micelle drug-loading system and preparation method and application thereof YAO JUNHUA 2016-02-03 CN claimed
CN-107629016-B Evans blue complex and preparation method and application thereof 莎穆(上海)生物科技有限公司 2020-05-22 CN disclosed
CN-105399938-B Preparation method and application of amphiphilic block copolymer and micelle thereof 江苏万高药业股份有限公司 2019-05-14 CN disclosed
CN-105399931-B Amphiphilic block copolymer and preparation method and application thereof 江苏万高药业股份有限公司 2019-05-03 CN disclosed
CN-105640882-A Cabazitaxel micelle drug loading system and preparation method and application thereof 姚俊华 2016-06-08 CN disclosed
CN-105399931-A Amphiphilic block copolymer and preparation method and application thereof YAO JUNHUA 2016-03-16 CN disclosed
CN-105399938-A Preparation method and application of amphiphilic block copolymer and micelle thereof YAO JUNHUA 2016-03-16 CN disclosed
CN-105395481-A Curcumin-containing polymer micelle drug delivery system and preparation method and application thereof YAO JUNHUA 2016-03-16 CN disclosed
CN-105310981-A Docetaxel micelle drug loading system and preparation method and application thereof YAO JUNHUA 2016-02-10 CN disclosed
CN-105287377-A Paclitaxel polymer micelle drug-loading system and preparation method and application thereof YAO JUNHUA 2016-02-03 CN disclosed
EP-2392400-B1 Homogeneous asymmetric hydrogenation method TAKASAGO PERFUMERY CO LTD (JP) 2014-05-07 EP disclosed
EP-2392400-A2 Homogeneous asymmetric hydrogenation catalyst Takasago International Corporation (JP) 2011-12-07 EP disclosed