SCHEMBL23255102

SCHEMBL23255102

CC(C)Oc1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccc(Oc4ccc(S(=O)(=O)c5ccc(C(C)(C)C)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ CNR2 P34972 2/20 0.44
▸ HSD11B1 P28845 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ MMP2 P08253 2/20 0.39
▸ MMP3 P08254 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ MMP14 P50281 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ PGR P06401 2/20 0.39
▸ NR1H4 Q96RI1 1/20 0.39
▸ MMP13 P45452 1/20 0.38
▸ FFAR1 O14842 1/20 0.38
▸ NPC1 O15118 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL23255103 0.97 HTT (0.42) HTTSMN1; SMN2CNR2HSD11B1RAB9A
SCHEMBL19382936 0.87 MMP14 (0.48) HTTSMN1; SMN2HSD11B1RAB9AMEN1
SCHEMBL10066694 0.87 MMP14 (0.48) HTTSMN1; SMN2HSD11B1RAB9AMEN1
SCHEMBL19383057 0.83 MMP14 (0.45) HTTSMN1; SMN2HSD11B1RAB9AMEN1
SCHEMBL24795065 0.83 MMP14 (0.45) HTTSMN1; SMN2HSD11B1RAB9AMEN1
SCHEMBL20007864 0.83 PTPN5 (0.46) HTTSMN1; SMN2HSD11B1RAB9AMMP2
SCHEMBL18407080 0.83 PTPN5 (0.46) HTTSMN1; SMN2HSD11B1RAB9AMMP2
SCHEMBL17146887 0.83 NR1H4 (0.50) HSD11B1MEN1KMT2AMMP2MMP3
SCHEMBL23255237 0.82 CNR2 (0.33) HTTSMN1; SMN2CNR2RAB9AMEN1
SCHEMBL24513216 0.82 HTT (0.51) HTTSMN1; SMN2CNR2HSD11B1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1850368-B2 FILM FORMING COMPOSITION AND ORGANIC ELECTROLUMINESCENT DEVICE PIONEER CORP (JP) 2021-04-21 — — EP disclosed
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