SCHEMBL29596409

SCHEMBL29596409

CC1=Cc2c(cc3c(c2-c2ccccc2)CCC3)C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.35
KDM4E B2RXH2 4/20 0.34
MAPT P10636 4/20 0.34
HSD17B10 Q99714 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
TSHR P16473 1/20 0.34
CYP2C19 P33261 1/20 0.34
MYC P01106 1/20 0.34
NLRP3 Q96P20 4/20 0.33
FPR1 P21462 1/20 0.33
ABCB1 P08183 1/20 0.32
MAPK1 P28482 2/20 0.32
LMNA P02545 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
SCHEMBL3697443 1.00 BRD4 (0.35) BRD4KDM4EMAPTHSD17B10ALDH1A1
SCHEMBL28723735 0.98 BRD4 (0.35) BRD4KDM4EMAPTHSD17B10ALDH1A1
Lithium SCHEMBL29767634 0.98 BRD4 (0.35) BRD4KDM4EMAPTHSD17B10ALDH1A1
SCHEMBL27171024 0.91 HSD17B10 (0.31) BRD4KDM4EMAPTHSD17B10ALDH1A1
SCHEMBL23014380 0.89 MEN1 (0.34) BRD4MEN1KMT2ANLRP3CES1
SCHEMBL29882271 0.89 MEN1 (0.34) BRD4MEN1KMT2ANLRP3CES1
Lithium SCHEMBL29882019 0.88 MEN1 (0.33) BRD4MEN1KMT2ANLRP3CES1
SCHEMBL22776383 0.85 FGF23 (0.32) KDM4EMEN1KMT2A
SCHEMBL29595700 0.85 FGF23 (0.32) KDM4EMEN1KMT2A
SCHEMBL23014487 0.84 MEN1 (0.33) MAPTALDH1A1MEN1KMT2ACES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114401977-B Transition metal compound and catalyst composition comprising the same 株式会社LG化学 2024-08-02 CN disclosed
EP-4271718-A1 POLYOLEFIN-BASED IONOMERS AND PRODUCTION THEREOF ExxonMobil Chemical Patents Inc. (US) 2023-11-08 EP disclosed
CN-113614119-B Hybrid supported metallocene catalyst and method for preparing polypropylene using the same 株式会社LG化学 2023-04-11 CN disclosed
WO-2022146634-A1 POLYOLEFIN-BASED IONOMERS AND PRODUCTION THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2022-07-07 WO disclosed
CN-111372954-B Preparation of polyethylene (bis) silicon-bridged metallocenes with broad molecular weight distribution and molecular weight 埃克森美孚化学专利公司 2022-06-28 CN disclosed
CN-114401977-A Transition metal compound and catalyst composition comprising the same 株式会社LG化学 2022-04-26 CN disclosed