SCHEMBL30987016

SCHEMBL30987016

CC(C)(C)CC(C)(C)c1ccc(O)c(-c2ccccc2-c2cccc3[nH]nnc23)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 1/20 0.38
HIF1A Q16665 1/20 0.38
SHBG P04278 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPK1 P28482 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
USP2 O75604 1/20 0.35
ESR1 P03372 1/20 0.35
TP53 P04637 1/20 0.35
PGR P06401 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
AR P10275 1/20 0.35
MAPT P10636 1/20 0.35
DRD1 P21728 1/20 0.35
PTGS1 P23219 1/20 0.35
SLC6A2 P23975 1/20 0.35
PDE4A P27815 1/20 0.35
CASP1 P29466 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
SCHEMBL29238423 1.00 CYP3A4 (0.38) CYP3A4CYP2D6HIF1ASHBGMEN1
SCHEMBL2595375 0.98 CYP3A4 (0.39) CYP3A4CYP2D6HIF1ASHBGMEN1
SCHEMBL28362300 0.93 CNR1 (0.35) CYP3A4CYP2D6HIF1ASHBGMEN1
SCHEMBL4451239 0.84 MEN1 (0.40) CYP3A4CYP2D6MEN1KMT2ASMN1; SMN2
SCHEMBL31570218 0.84 MEN1 (0.40) CYP3A4CYP2D6MEN1KMT2ASMN1; SMN2
SCHEMBL31570219 0.84 MEN1 (0.40) CYP3A4CYP2D6MEN1KMT2ASMN1; SMN2
SCHEMBL14778442 0.83 SHBG (0.32) CYP3A4CYP2D6HIF1ASHBGMEN1
SCHEMBL9437939 0.82 CNR1 (0.42) CYP3A4MEN1KMT2AESR1GAA
SCHEMBL4409978 0.82 CNR1 (0.50) CNR1CNR2
SCHEMBL7099284 0.82 CYP3A4 (0.38) CYP3A4CYP2D6HIF1ASHBGMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410562-B Thermosetting resin composition and application thereof 广东生益科技股份有限公司 2025-05-13 CN disclosed
CN-118633044-A Member for head-mounted display and optical lens using the same 三菱瓦斯化学株式会社 2024-09-10 CN disclosed
CN-118355052-A Polycarbonate resin and method for producing same 三菱瓦斯化学株式会社 2024-07-16 CN disclosed