SCHEMBL28889587

SCHEMBL28889587

CCCCCCOc1ccc(-c2ccc(C(=O)Oc3ccc4ccccc4c3-c3c(-c4cc(-c5ccc(OCCCCCC)cc5)ccc4C(=O)O)ccc4ccccc34)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 8/20 0.48
▸ RARB P10826 4/20 0.47
▸ PTPN1 P18031 1/20 0.43
▸ PTPN6 P29350 1/20 0.43
▸ PLK1 P53350 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ RARA P10276 1/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ PLA2G4B P0C869 1/20 0.42

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
SCHEMBL881060 0.87 RARB (0.55) RARBTP53TSHRCNR1CNR2
SCHEMBL881059 0.86 RARB (0.53) RARBTP53TSHRCNR1CNR2
SCHEMBL13452752 0.82 LMNA (0.58) TP53TSHRCNR1CNR2PLA2G4B
SCHEMBL31404682 0.82 RARB (0.49) RARBTP53TSHRCNR1CNR2
SCHEMBL31404692 0.79 RARB (0.46) RARBTP53TSHRCNR1CNR2
SCHEMBL31404691 0.78 RARB (0.47) RARBTP53TSHRCNR1CNR2
SCHEMBL9161712 0.77 RARB (0.64) PTPN11RARBPTPN1PTPN6TP53
SCHEMBL10593313 0.77 RARB (0.64) PTPN11RARBPLK1TP53TSHR
SCHEMBL15284865 0.77 RARB (0.50) PTPN11RARBTP53TSHRRARA
SCHEMBL15292227 0.77 RARB (0.50) PTPN11RARBTP53TSHRRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115368912-B Liquid crystal composition, reflective film and preparation method thereof 上海先认新材料合伙企业(有限合伙) 2024-05-14 — — CN claimed
CN-115368912-B Liquid crystal composition, reflective film and preparation method thereof 上海先认新材料合伙企业(有限合伙) 2024-05-14 — — CN disclosed
CN-115368912-A Liquid crystal composition, reflective film and preparation method thereof 上海先认新材料合伙企业(有限合伙) 2022-11-22 — — CN disclosed
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