SCHEMBL6289217

SCHEMBL6289217

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
ESR1 P03372 5/20 0.35
ESR2 Q92731 4/20 0.35
CHRNA4 P43681 2/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
TSHR P16473 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
SLC6A2 P23975 1/20 0.31
HTR2A P28223 1/20 0.31
SLC6A4 P31645 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
SCHEMBL24692108 0.85 ALDH1A1 (0.41) ALDH1A1THRATHRBESR1ESR2
SCHEMBL1611980 0.81 THRA (0.53) ALDH1A1THRATHRBESR1ESR2
SCHEMBL16301950 0.81 ALDH1A1 (0.41) ALDH1A1THRATHRBESR1ESR2
SCHEMBL7216235 0.78 ALDH1A1 (0.42) ALDH1A1THRATHRBESR1ESR2
SCHEMBL6286632 0.78 TP53 (0.44) ALDH1A1TSHRHDAC8TDP1CYP3A4
SCHEMBL27520515 0.78 SLC6A2 (0.55) ALDH1A1THRATHRBESR1CHRNA4
SCHEMBL10597489 0.78 ALDH1A1 (0.46) ALDH1A1THRATHRBESR1ESR2
SCHEMBL21330385 0.78 ALDH1A1 (0.46) ALDH1A1THRATHRBESR1ESR2
SCHEMBL19434103 0.77 ALDH1A1 (0.37) ALDH1A1CHRNA4CHRNB2CHRNB4CHRNA3
SCHEMBL14350828 0.76 TP53 (0.42) ALDH1A1ESR1ESR2CHRNA4TSHR

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