SCHEMBL9637962

SCHEMBL9637962

C=C(C)Cc1ccc(C(C)(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
TYR P14679 1/20 0.44
KCNH2 Q12809 1/20 0.44
NR1H4 Q96RI1 4/20 0.44
EPHX2 P34913 2/20 0.44
ESRRB O95718 1/20 0.42
ESRRG P62508 1/20 0.42
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 2/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
NLRP3 Q96P20 1/20 0.41
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
BCHE P06276 2/20 0.39
ACHE P22303 2/20 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
SCHEMBL6015468 0.83 ALDH1A1 (0.38) MAPTSMN1; SMN2ALDH1A1
SCHEMBL21610452 0.81 HDAC1 (0.49) RXRARXRBRXRGNLRP3ALDH1A1
SCHEMBL9776327 0.80 NR1H4 (0.40) LMNATYRKCNH2NR1H4EPHX2
SCHEMBL22766230 0.79 NR1H4 (0.46) LMNATYRKCNH2NR1H4EPHX2
SCHEMBL6568394 0.78 LMNA (0.44) LMNATYRKCNH2NR1H4EPHX2
SCHEMBL4689867 0.78 NR1H4 (0.51) LMNANR1H4EPHX2ESRRBESRRG
SCHEMBL9362177 0.78 ESRRG (0.43) LMNATYRKCNH2NR1H4EPHX2
SCHEMBL23230257 0.77 LMNA (0.43) LMNAMAPTTSHRRXRARXRB
SCHEMBL4578764 0.76 NR1H4 (0.50) LMNANR1H4EPHX2ESRRBESRRG
SCHEMBL9637958 0.76 CYP1A2 (0.45) NR1H4MAPTRXRARXRBBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109642184-A Product including plastic containers and composition of matter 西姆莱斯有限公司 2019-04-16 CN claimed
US-20250235136-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2025-07-24 US disclosed
US-12336820-B2 Methods of preparing/optimizing perfume compositions GIVAUDAN SA (CH) 2025-06-24 US disclosed
US-20220334094-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2022-10-20 US disclosed
EP-0294557-B1 PROCESS FOR THE PREPARATION OF 3-PHENYL-2-METHYLPROPANOL AND ITS PARA-SUBSTITUTED ALKYLIC DERIVATIVES HÜLS AKTIENGESELLSCHAFT (DE) 1992-07-08 EP disclosed
EP-0192845-B1 PROCESS FOR THE PREPARATION OF PURE METHALLYL BENZENE OR OF BUTENYL BENZENE, AND ITS P-ALKYL DERIVATIVES HÜLS AKTIENGESELLSCHAFT (DE) 1989-02-15 EP disclosed
EP-0294557-A2 Process for the preparation of 3-phenyl-2-methylpropanol and its para-substituted alkylic derivatives HÜLS AKTIENGESELLSCHAFT (DE) 1988-12-14 EP disclosed
US-4785100-A BROMINATION FOLLOWED BY AMINATION HUELS AKTIENGESELLSHAFT (DE) 1988-11-15 US disclosed
EP-0262348-A2 Process for the preparation of N-substituted morpholine and piperidine derivatives HÜLS AKTIENGESELLSCHAFT (DE) 1988-04-06 EP disclosed
US-4642405-A POLYMERIZATION INHIBITORS HUELS AKTIENGESELLSCHAFT (DE) 1987-02-10 US disclosed
EP-0192845-A1 Process for the preparation of pure methallyl benzene or of butenyl benzene, and its p-alkyl derivatives HÜLS AKTIENGESELLSCHAFT (DE) 1986-09-03 EP disclosed