SCHEMBL28192556

SCHEMBL28192556

Oc1ccccc1-c1ccccc1C1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.47
▸ BCHE P06276 1/20 0.46
▸ ACHE P22303 1/20 0.46
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ CHRM2 P08172 1/20 0.42
▸ CHRM4 P08173 1/20 0.42
▸ CHRM5 P08912 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CHRM3 P20309 1/20 0.42
▸ PTGDR2 Q9Y5Y4 1/20 0.41
▸ PTPN5 P54829 3/20 0.41
▸ PTPN2 P17706 1/20 0.41
▸ HDAC4 P56524 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ NUDT1 P36639 1/20 0.39
▸ BACE1 P56817 1/20 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
SCHEMBL4476575 0.88 PTGS2 (0.56) PTGS2BCHEACHEPTGDR2PTPN5
Phosphine SCHEMBL2085257 0.86 PTGS2 (0.54) PTGS2BCHEACHEPTGDR2PTPN5
SCHEMBL55659 0.84 KMT2A (0.55) PTGS2BCHEACHEMEN1KMT2A
SCHEMBL15485147 0.84 KMT2A (0.55) PTGS2BCHEACHEMEN1KMT2A
SCHEMBL4556222 0.84 KMT2A (0.55) PTGS2BCHEACHEMEN1KMT2A
SCHEMBL3356780 0.84 KMT2A (0.55) PTGS2BCHEACHEMEN1KMT2A
SCHEMBL4959102 0.84 KMT2A (0.55) PTGS2BCHEACHEMEN1KMT2A
SCHEMBL4959489 0.84 KMT2A (0.55) PTGS2BCHEACHEMEN1KMT2A
SCHEMBL4960570 0.84 KMT2A (0.55) PTGS2BCHEACHEMEN1KMT2A
2-Phenylphenol SCHEMBL23295079 0.82 ALDH1A1 (0.57) PTGS2MEN1KMT2APTGDR2PTPN5

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-107522827-A A kind of photocuring 3D printing photosensitive resin and its preparation method and application 杨军 2017-12-29 — — CN claimed
CN-110437376-A High-precision 3D printing thermochromic material and preparation method thereof and its application method HUNAN SHENGWEI NEW MAT CO LTD 2019-11-12 — — CN disclosed
CN-110437385-A A kind of 3D printing photochromic material and preparation method thereof and its application method HUNAN SHENGWEI NEW MAT CO LTD 2019-11-12 — — CN disclosed
CN-107522827-A A kind of photocuring 3D printing photosensitive resin and its preparation method and application 杨军 2017-12-29 — — CN disclosed
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