SCHEMBL29155309

SCHEMBL29155309

C=Cc1cccc(-c2ccccc2C)c1C=C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
CYP1A2 P05177 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
TP53 P04637 2/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
ACHE P22303 1/20 0.33
MAPT P10636 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33

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
SCHEMBL6520322 0.87 ALDH1A1 (0.52) ALDH1A1TSHRCYP1A2KDM4ECYP2C19
SCHEMBL4288834 0.85 ALDH1A1 (0.42) ALDH1A1TSHRTP53TDP1
SCHEMBL8613228 0.84 ALDH1A1 (0.43) ALDH1A1TSHRCYP1A2KDM4ECYP2C19
SCHEMBL17796299 0.84 ALDH1A1 (0.43) ALDH1A1TSHR
SCHEMBL8848264 0.84 ALDH1A1 (0.43) ALDH1A1TSHR
SCHEMBL28139493 0.82 ALDH1A1 (0.39) ALDH1A1TSHRCYP1A2KDM4ECYP2C19
SCHEMBL7921184 0.82 ALDH1A1 (0.41) ALDH1A1TSHRCYP1A2KDM4ECYP2C19
SCHEMBL28085441 0.82 ALDH1A1 (0.46) ALDH1A1TSHRCYP1A2KDM4ECYP2C19
SCHEMBL41438 0.81 ALDH1A1 (0.39) ALDH1A1TSHRCYP1A2KDM4ETP53
SCHEMBL30332485 0.81 ALDH1A1 (0.39) ALDH1A1TSHRCYP1A2KDM4ETP53

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-115991951-B Composite coating, preparation method and device 江苏菲沃泰纳米科技股份有限公司 2024-02-20 CN claimed
CN-115991951-A Composite coating, preparation method and device 江苏菲沃泰纳米科技股份有限公司 2023-04-21 CN claimed
CN-115991951-B Composite coating, preparation method and device 江苏菲沃泰纳米科技股份有限公司 2024-02-20 CN disclosed
CN-115991951-A Composite coating, preparation method and device 江苏菲沃泰纳米科技股份有限公司 2023-04-21 CN disclosed