SCHEMBL18489595

SCHEMBL18489595

CC(C)c1cccc(C(C)C)c1/N=C/Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.41
MAOB P27338 1/20 0.38
SLC6A2 P23975 3/20 0.37
TAAR1 Q96RJ0 2/20 0.37
MAOA P21397 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
CYP2A6 P11509 1/20 0.37
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
GABRA1 P14867 3/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
LMNA P02545 2/20 0.36
KMT2A Q03164 1/20 0.36
SOAT2 O75908 1/20 0.35
SOAT1 P35610 1/20 0.35
GABRB2 P47870 2/20 0.35
FAAH O00519 1/20 0.35

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
SCHEMBL1069878 1.00 BACE1 (0.41) BACE1MAOBSLC6A2TAAR1MAOA
SCHEMBL21239553 0.90 KCNN2 (0.38) BACE1SLC6A2SIGMAR1GABRA1GABRG2
SCHEMBL1758905 0.83 TAAR1 (0.37) MAOBTAAR1SIGMAR1KMT2A
SCHEMBL15828371 0.81 GABRA1 (0.43) SLC6A2GABRA1GABRG2GABRB3LMNA
SCHEMBL21113635 0.78 EPHX1 (0.39) MAOBMAOALMNAKMT2ACYP1A2
SCHEMBL28847320 0.78 GABRA1 (0.41) SLC6A2GABRA1GABRG2GABRB3LMNA
SCHEMBL932704 0.78 GABRA1 (0.35) BACE1SLC6A2TAAR1GABRA1GABRG2
SCHEMBL18544054 0.77 BACE1 (0.33) BACE1GABRA1GABRG2GABRB3LMNA
SCHEMBL5589867 0.77 TAAR1 (0.36) SLC6A2TAAR1GABRA1GABRG2GABRB3
SCHEMBL1071465 0.77 MAOB (0.41) BACE1MAOBSLC6A2SLC6A4KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3135699-B1 CATALYST COMPONENT FOR PROPYLENE POLYMERIZATION, PREPARATION METHOD THEREFOR AND CATALYST HAVING SAME CHINA PETROLEUM & CHEM CORP (CN) 2021-07-21 EP claimed
EP-3135699-B1 CATALYST COMPONENT FOR PROPYLENE POLYMERIZATION, PREPARATION METHOD THEREFOR AND CATALYST HAVING SAME CHINA PETROLEUM & CHEM CORP (CN) 2021-07-21 EP disclosed
US-10184017-B2 Catalyst component for propene polymerization, preparation method thereof, and catalyst containing the same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2019-01-22 US disclosed
EP-3135699-A1 CATALYST COMPONENT FOR PROPYLENE POLYMERIZATION, PREPARATION METHOD THEREFOR AND CATALYST HAVING SAME China Petroleum & Chemical Corporation (CN) 2017-03-01 EP disclosed
US-20170044280-A1 Catalyst Component for Propene Polymerization, Preparation Method Thereof, and Catalyst Containing the Same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2017-02-16 US disclosed