SCHEMBL24725070

SCHEMBL24725070

Cc1ccc(C2C(C(=O)Nc3ccccc3)CCCN2C(=O)c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.48
▸ TP53 P04637 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ GAA P10253 3/20 0.47
▸ KDM4E B2RXH2 1/20 0.45
▸ NAMPT P43490 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ USP2 O75604 1/20 0.43

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
SCHEMBL12160730 0.92 L3MBTL1 (0.47) NPC1TP53RAB9ASMN1; SMN2ALDH1A1
SCHEMBL12160900 0.92 L3MBTL1 (0.47) NPC1TP53RAB9ASMN1; SMN2ALDH1A1
SCHEMBL26878431 0.88 LMNA (0.48) NPC1RAB9AALDH1A1NAMPTPOLB
SCHEMBL26899136 0.88 NPC1 (0.46) NPC1TP53TSHRRAB9ASMN1; SMN2
SCHEMBL25083897 0.88 LMNA (0.48) NPC1RAB9AALDH1A1NAMPTPOLB
SCHEMBL12160727 0.81 MEN1 (0.50) NPC1RAB9ASMN1; SMN2ALDH1A1GAA
SCHEMBL12160901 0.81 MEN1 (0.50) NPC1RAB9ASMN1; SMN2ALDH1A1GAA
SCHEMBL12176425 0.81 KMT2A (0.58) NPC1TP53TSHRRAB9ASMN1; SMN2
SCHEMBL15088272 0.80 ALDH1A1 (0.48) TP53TSHRALDH1A1GAAKMT2A
SCHEMBL25083896 0.79 POLB (0.48) TSHRSMN1; SMN2ALDH1A1GAAPOLB

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
WO-2022235699-A2 POTENT ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF IMMUNOGLOBULINS AND OTHER PROTEINS AVILAR THERAPEUTICS, INC. (US) 2022-11-10 — — WO disclosed
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