SCHEMBL28512389

SCHEMBL28512389

Cc1ccc(-c2cnn(O)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 1/20 0.41
▸ METAP1 P53582 1/20 0.41
▸ NPC1 O15118 9/20 0.40
▸ RAB9A P51151 9/20 0.40
▸ SMN1; SMN2 Q16637 9/20 0.40
▸ MAPT P10636 6/20 0.40
▸ KMT2A Q03164 6/20 0.40
▸ MEN1 O00255 5/20 0.40
▸ TP53 P04637 3/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ ALDH1A1 P00352 8/20 0.39
▸ KDM4E B2RXH2 5/20 0.39
▸ MITF O75030 2/20 0.39
▸ KDM5A P29375 1/20 0.39
▸ KDM5C P41229 1/20 0.39
▸ PAX8 Q06710 1/20 0.39
▸ HPGD P15428 2/20 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
SCHEMBL9418749 0.79 KMT2A (0.43) METAP2NPC1RAB9ASMN1; SMN2MAPT
Ammonia Solution, Strong SCHEMBL28862485 0.76 AOC3 (0.43) METAP2METAP1NPC1RAB9ASMN1; SMN2
SCHEMBL11473126 0.74 NPC1 (0.46) METAP2METAP1NPC1RAB9ASMN1; SMN2
SCHEMBL18608951 0.74 CHRM2 (0.44) METAP2METAP1NPC1RAB9ASMN1; SMN2
SCHEMBL28512390 0.71 IDO1 (0.46) METAP2NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5047937 0.68 TLR8 (0.51) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL10205815 0.66 CCR1 (0.55) METAP2METAP1NPC1RAB9ASMN1; SMN2
SCHEMBL12264964 0.64 MEN1 (0.55) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL12319225 0.64 KEAP1 (0.67) METAP2METAP1NPC1RAB9ASMN1; SMN2
SCHEMBL10000254 0.63 NPC1 (0.61) METAP2METAP1NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112759914-A Compound halogen-free flame-retardant engineering resin and preparation method and application thereof 上海中镭新材料科技有限公司 2021-05-07 — — CN claimed
CN-112322019-A High-hardness transparent flame-retardant PC material and preparation method thereof 上海艰卓科技有限公司 2021-02-05 — — CN disclosed
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