SCHEMBL28401252

SCHEMBL28401252

CCc1cc(C(=O)OC(=O)c2ccccc2)ccc1CC(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.41
▸ PDCD1 Q15116 1/20 0.39
▸ CD274 Q9NZQ7 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ ELANE P08246 4/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ F2 P00734 1/20 0.37
▸ ADRB2 P07550 1/20 0.37
▸ ADRB1 P08588 1/20 0.37
▸ ADRB3 P13945 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ CES2 O00748 1/20 0.37
▸ CES1 P23141 1/20 0.37

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
SCHEMBL28398716 0.94 TSHR (0.41) LMNAPDCD1CD274TSHRELANE
SCHEMBL28401251 0.93 ALOX15 (0.37) LMNATSHRSMN1; SMN2ALDH1A1
SCHEMBL28403587 0.88 LMNA (0.47) LMNATSHRELANESMN1; SMN2ALDH1A1
SCHEMBL28398713 0.86 CA12 (0.39) TSHRSMN1; SMN2ALDH1A1GAA
SCHEMBL28401246 0.86 CES2 (0.41) LMNAPDCD1CD274TSHRELANE
SCHEMBL28407122 0.82 PPARG (0.44) ALDH1A1
SCHEMBL28407174 0.81 GABRA1 (0.42) LMNAPDCD1CD274TSHRELANE
SCHEMBL23346538 0.80 ALDH1A1 (0.46) TSHRSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL28403585 0.79 CA12 (0.43) LMNAELANESMN1; SMN2ALDH1A1HTT
SCHEMBL28401901 0.79 LMNA (0.45) LMNATSHRELANESMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111234070-B Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2022-03-01 — — CN claimed
CN-111234073-B Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2021-12-31 — — CN claimed
CN-111234073-A Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2020-06-05 — — CN claimed
CN-111234070-A Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2020-06-05 — — CN claimed
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