SCHEMBL6286632

SCHEMBL6286632

C=Cc1cccc(CC(C)(C)CC)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 2/20 0.34
TSHR P16473 1/20 0.34
FAAH O00519 1/20 0.33
PTGS2 P35354 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
ATM Q13315 1/20 0.31
HDAC8 Q9BY41 1/20 0.31

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
SCHEMBL13509648 0.83 MAOA (0.41) TDP1ALDH1A1
SCHEMBL27489104 0.81 SLC6A2 (0.52) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL18714200 0.81 TP53 (0.46) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL488945 0.78 TP53 (0.50) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL6289217 0.78 ALDH1A1 (0.44) TP53TDP1ALDH1A1TSHRCYP3A4
SCHEMBL30257186 0.78 TP53 (0.50) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL15783 0.77 TP53 (0.54) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL19066595 0.77 TP53 (0.42) TP53TDP1ALDH1A1TSHRFAAH
Benzene SCHEMBL28406629 0.76 TP53 (0.52) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL30540423 0.75 TP53 (0.47) TP53TDP1

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
US-20240182677-A1 Curable Compositions AGC Multi Material America, Inc. 2024-06-06 US disclosed
CN-118047914-A Curable composition AGC多材料美国有限公司 2024-05-17 CN disclosed
CN-116940608-A Curable composition AGC多材料美国有限公司 2023-10-24 CN disclosed
WO-2023164430-A1 CURABLE COMPOSITIONS AGC Multi Material America, Inc. (US) 2023-08-31 WO disclosed
US-20230265275-A1 Curable Compositions AGC Multi Material America, Inc. 2023-08-24 US disclosed
US-6900273-B1 Low-hygroscopicity low-birefringence resin compositions, molding material obtained therefrom, sheet or film, and optical part HITACHI CHEMICAL CO., LTD. (JP) 2005-05-31 US disclosed
US-20040220342-A1 Low-hygroscopicity low-birefringence resin compositions, molding material, sheet or film obtained therefrom, and optical part YAMASHITA YUKIHIKO (JP) 2004-11-04 US disclosed
EP-1205517-A1 LOW-HYGROSCOPICITY LOW-BIREFRINGENCE RESIN COMPOSITIONS, MOLDING MATERIAL OBTAINED THEREFROM, SHEET OR FILM, AND OPTICAL PART HITACHI CHEMICAL COMPANY, LTD. (JP) 2002-05-15 EP disclosed