SCHEMBL7776545

SCHEMBL7776545

CC1=Cc2ccc(C)cc2C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.37
ACHE P22303 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
RAB9A P51151 1/20 0.36
CYP2A6 P11509 3/20 0.35
CYP1A2 P05177 2/20 0.35
TDP1 Q9NUW8 2/20 0.34
PDE5A O76074 1/20 0.33
PARP10 Q53GL7 1/20 0.32
PARP11 Q9NR21 1/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 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
SCHEMBL30467249 1.00 METAP1 (0.37) METAP1ACHEKDM4EALDH1A1SMN1; SMN2
SCHEMBL29795094 0.82 METAP1 (0.37) METAP1ACHEKDM4EALDH1A1SMN1; SMN2
SCHEMBL9628953 0.82 METAP1 (0.37) METAP1ACHEKDM4EALDH1A1SMN1; SMN2
SCHEMBL18791369 0.80 METAP1 (0.36) METAP1KDM4EALDH1A1SMN1; SMN2POLB
SCHEMBL13239080 0.80 SRD5A1 (0.37) METAP1ACHEALDH1A1CYP2A6CYP1A2
SCHEMBL13799413 0.78 DRD1 (0.40) ACHE
SCHEMBL2973732 0.78 ALDH1A1 (0.37) METAP1ALDH1A1CYP2A6TRPA1
SCHEMBL1923451 0.78 METAP1 (0.35) METAP1ACHEKDM4EALDH1A1SMN1; SMN2
SCHEMBL21694433 0.78 ALDH1A1 (0.42) ACHEKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL5953558 0.78 DRD2 (0.38) METAP1CYP2A6CA12CA9CYP3A4

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
CN-116234883-A Electrodeposition coating composition comprising alkoxylated polyethylenimine 巴斯夫涂料有限公司 2023-06-06 CN disclosed
CN-112105654-A Curable resin mixture, curable resin composition, and cured product thereof 日本化药株式会社 2020-12-18 CN disclosed
WO-2020031935-A1 CURABLE RESIN MIXTURE, CURABLE RESIN COMPOSITION, AND CURED PRODUCT 日本化薬株式会社 2020-02-13 WO disclosed
CN-1227271-C Solid catalytic composition for olefin polymerization ATOCHEM ELF SA (FR) 2005-11-16 CN disclosed
EP-0889065-B1 Solid catalyst component for the polymerisation of olefins ATOFINA (FR) 2001-08-22 EP disclosed
US-6057258-A Solid catalytic component for the polymerization of olefins ELF ATOCHEM S.A. (FR) 2000-05-02 US disclosed
EP-0889065-A1 Solid catalyst component for the polymerisation of olefins ELF ATOCHEM S.A. (FR) 1999-01-07 EP disclosed
CN-1203924-A Solid catalytic composition for olefin polymerization ATOCHEM ELF SA (FR) 1999-01-06 CN disclosed