SCHEMBL30032773

SCHEMBL30032773

Cc1cc(C(N)=O)cc2[nH]cnc12

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 2/20 0.49
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ PNP P00491 1/20 0.40
▸ ACACB O00763 3/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ AR P10275 1/20 0.39
▸ RAB9A P51151 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ GDA Q9Y2T3 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.36
▸ CHEK2 O96017 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTT P42858 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
SCHEMBL1144576 0.85 KMT2A (0.43) PARP1KMT2AMEN1PNPACACB
SCHEMBL31337233 0.83 NPC1 (0.41) KMT2AMEN1PNPACACBHSD11B1
SCHEMBL31337199 0.81 KMT2A (0.43) KMT2AMEN1ACACBHSD11B1RAB9A
SCHEMBL30962498 0.81 RAB9A (0.42) PARP1KMT2AMEN1ACACBHSD11B1
SCHEMBL12653332 0.81 KMT2A (0.37) PARP1KMT2AMEN1PNPACACB
SCHEMBL19657122 0.81 CECR2 (0.42) PARP1KMT2AMEN1PNPACACB
SCHEMBL12618972 0.81 KMT2A (0.37) PARP1KMT2AMEN1PNPACACB
SCHEMBL29209466 0.80 TSHR (0.45) PARP1SMN1; SMN2KDM4EALDH1A1HTT
SCHEMBL30980915 0.76 PARP1 (0.45) PARP1PNPARRAB9ANPC1
SCHEMBL30962610 0.74 HTT (0.40) KMT2AMEN1ACACBRAB9ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115279370-A Compounds for targeted degradation of BRD9 C4医药公司 2022-11-01 — — CN disclosed
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