SCHEMBL28845957

SCHEMBL28845957

C#CC(O)C(CCCC)CCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.38
SPHK1 Q9NYA1 2/20 0.38
FFAR1 O14842 1/20 0.38
LMNA P02545 2/20 0.37
DNM1 Q05193 1/20 0.36
CYP2D6 P10635 2/20 0.35
GMNN O75496 1/20 0.35
POLB P06746 1/20 0.35
THPO P40225 1/20 0.35
MTOR P42345 1/20 0.35
BLM P54132 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
CETP P11597 1/20 0.35
HTT P42858 1/20 0.35
UBE2N P61088 1/20 0.35
CA2 P00918 1/20 0.35

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
SCHEMBL31595792 0.88 GPR84 (0.39) GPR84SPHK1FFAR1LMNACYP2D6
SCHEMBL179938 0.87 ALDH1A1 (0.37) LMNADNM1CYP3A4CA2
SCHEMBL16091691 0.81 SPHK1 (0.33) SPHK1
SCHEMBL11059055 0.77 SPHK1 (0.40) SPHK1LMNADNM1CYP2D6GMNN
SCHEMBL14515798 0.77 GPR84 (0.41) GPR84SPHK1FFAR1LMNADNM1
SCHEMBL10973720 0.76 SPHK1 (0.34) SPHK1DNM1CA2
SCHEMBL10973718 0.76 SPHK1 (0.34) SPHK1DNM1CA2
SCHEMBL10973716 0.76 SPHK1 (0.34) SPHK1DNM1CA2
SCHEMBL10975144 0.76 SPHK1 (0.34) SPHK1DNM1CA2
SCHEMBL134483 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115073412-B Fluorescent group modified indene fused ring naphthopyran photochromic compound and preparation method and application thereof 天津孚信阳光科技有限公司 2024-05-07 CN claimed
CN-114014886-B Silicon fused ring naphthopyran photochromic compound and preparation method and application thereof 南开大学 2022-12-27 CN claimed
CN-115073412-A Fluorescent group modified indene fused ring naphthopyran photochromic compound and preparation method and application thereof 天津孚信阳光科技有限公司 2022-09-20 CN claimed
CN-114014886-A Silicon-fused-ring naphthopyran photochromic compound and preparation method and application thereof 南开大学 2022-02-08 CN claimed
CN-115073412-B Fluorescent group modified indene fused ring naphthopyran photochromic compound and preparation method and application thereof 天津孚信阳光科技有限公司 2024-05-07 CN disclosed
CN-114014886-B Silicon fused ring naphthopyran photochromic compound and preparation method and application thereof 南开大学 2022-12-27 CN disclosed
CN-110343084-B Double-condensed ring naphthopyran photochromic compound and preparation method thereof 天津孚信阳光科技有限公司 2022-12-02 CN disclosed
CN-110343084-B Double-condensed ring naphthopyran photochromic compound and preparation method thereof 天津孚信阳光科技有限公司 2022-12-02 CN disclosed
CN-115073412-A Fluorescent group modified indene fused ring naphthopyran photochromic compound and preparation method and application thereof 天津孚信阳光科技有限公司 2022-09-20 CN disclosed
CN-114014886-A Silicon-fused-ring naphthopyran photochromic compound and preparation method and application thereof 南开大学 2022-02-08 CN disclosed