SCHEMBL19625543

SCHEMBL19625543

CCc1cccc(CC)c1/N=C1C(=N/c2c(CC)cccc2CC)/c2cccc3cccc/1c23

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 1/20 0.44
GABRA1 P14867 4/20 0.44
GABRB2 P47870 4/20 0.44
ALDH1A1 P00352 7/20 0.42
CES2 O00748 1/20 0.42
BCHE P06276 1/20 0.42
CES1 P23141 1/20 0.42
MCL1 Q07820 1/20 0.42
HSD17B10 Q99714 3/20 0.40
TYMS P04818 2/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 2/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PARP1 P09874 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
KDM4E B2RXH2 3/20 0.38
GAA P10253 1/20 0.38
RECQL P46063 1/20 0.38
HPGD P15428 5/20 0.38

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
SCHEMBL31619719 0.93 CYP1B1 (0.40) CYP1B1GABRA1GABRB2ALDH1A1CES2
SCHEMBL19625541 0.90 POLB (0.41) CYP1B1GABRA1GABRB2ALDH1A1CES2
SCHEMBL31619755 0.85 ALDH1A1 (0.37) CYP1B1GABRA1GABRB2ALDH1A1TDP1
SCHEMBL29310670 0.81 GABRA1 (0.41) GABRA1GABRB2POLB
SCHEMBL19625537 0.78 NR3C2 (0.37) CYP1B1ALDH1A1CES2BCHECES1
SCHEMBL5588472 0.75 POLB (0.49) CYP1B1ALDH1A1CES2BCHECES1
SCHEMBL21563329 0.75 POLB (0.49) CYP1B1ALDH1A1CES2BCHECES1
SCHEMBL5588478 0.75 POLB (0.49) CYP1B1ALDH1A1CES2BCHECES1
SCHEMBL31619779 0.74 PDCD1 (0.37) CYP1B1GABRA1GABRB2ALDH1A1KDM4E
SCHEMBL31619780 0.74 MAOA (0.37) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228680-A1 METHOD FOR PREPARING POLYMER, AND OBTAINED POLYMER CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2024-07-11 US disclosed
US-20240228680-A1 METHOD FOR PREPARING POLYMER, AND OBTAINED POLYMER CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2024-07-11 US disclosed
US-11332552-B2 Low pressure process for preparing low-density polyethylene CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2022-05-17 US disclosed
US-10961331-B2 Ethylene homopolymers with a reverse short chain branch distribution CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2021-03-30 US disclosed
WO-2020131442-A1 ETHYLENE HOMOPOLYMERS WITH A REVERSE SHORT CHAIN BRANCH DISTRIBUTION CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2020-06-25 WO disclosed
US-20200199265-A1 Ethylene Homopolymers with a Reverse Short Chain Branch Distribution CHEVRON PHILLIPS CHEMICAL COMPANY LP 2020-06-25 US disclosed
US-20170335022-A1 LOW PRESSURE PROCESS FOR PREPARING LOW-DENSITY POLYETHYLENE CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2017-11-23 US disclosed
US-20170335022-A1 LOW PRESSURE PROCESS FOR PREPARING LOW-DENSITY POLYETHYLENE CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2017-11-23 US disclosed