SCHEMBL28679705

SCHEMBL28679705

CC(C)Cc1ccc(C(=O)Oc2ccc(OP(=O)(O)O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.48
PTGS2 P35354 4/20 0.44
CTSL P07711 1/20 0.42
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PRSS1 P07477 5/20 0.40
F2 P00734 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
TMPRSS15 P98073 3/20 0.40
ACR P10323 1/20 0.39
SRC P12931 1/20 0.39
PTGS1 P23219 3/20 0.39
LMNA P02545 2/20 0.39
CYP2C9 P11712 2/20 0.39
AKR1C3 P42330 2/20 0.39
CXCR1 P25024 2/20 0.39
CXCR2 P25025 2/20 0.39
ALB P02768 1/20 0.39
ESR1 P03372 1/20 0.39

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
SCHEMBL20714775 0.87 BLM (0.51) BLMPTGS2CYP2C19SMN1; SMN2SRC
SCHEMBL28677934 0.85 BLM (0.57) BLMCYP2C19SMN1; SMN2PRSS1F2
SCHEMBL28679708 0.82 SRC (0.41) BLMPTGS2SMN1; SMN2PRSS1ACR
SCHEMBL28673770 0.82 BLM (0.53) BLMCYP2C19SMN1; SMN2PRSS1F2
SCHEMBL28681788 0.81 PRSS1 (0.58) BLMSMN1; SMN2PRSS1ACRSRC
SCHEMBL17236371 0.81 KMT2A (0.55) BLMPTGS2CTSLPTGS1LMNA
SCHEMBL1790172 0.81 MAPT (0.50) BLMPTGS2CTSLSMN1; SMN2PRSS1
SCHEMBL28677912 0.79 PRSS1 (0.55) BLMSMN1; SMN2PRSS1ACRLMNA
SCHEMBL9369179 0.79 SRD5A2 (0.51) CTSLSMN1; SMN2
SCHEMBL19485876 0.79 SMN1; SMN2 (0.51) PTGS2CYP2C19SMN1; SMN2PRSS1ACR

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-114085301-A Solid catalyst component for preparing olefin polymer and application thereof 中国石油化工股份有限公司 2022-02-25 CN claimed
CN-113929797-A Solid catalyst component and catalyst system for producing polymers 中国石油化工股份有限公司 2022-01-14 CN claimed
CN-113929799-A Catalyst component for olefin polymerization, catalyst system and application 中国石油化工股份有限公司 2022-01-14 CN claimed