SCHEMBL25142631

SCHEMBL25142631

CNc1ccc(C(=O)Nc2ncc(C)s2)c(C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 14/20 0.53
▸ NPC1 O15118 11/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ SMN1; SMN2 Q16637 7/20 0.53
▸ ALDH1A1 P00352 5/20 0.53
▸ LMNA P02545 2/20 0.53
▸ MITF O75030 2/20 0.53
▸ POLB P06746 2/20 0.52
▸ PKM P14618 3/20 0.51
▸ MAPT P10636 2/20 0.50
▸ PAX8 Q06710 2/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ NFKB2 Q00653 1/20 0.50
▸ RELA Q04206 1/20 0.50
▸ KDM4E B2RXH2 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ MAPK1 P28482 1/20 0.47

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
SCHEMBL31665510 1.00 RAB9A (0.53) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL24073697 0.88 ADORA2A (0.45) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL25142552 0.88 RAB9A (0.52) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL24072284 0.87 ADORA2A (0.44) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL24072763 0.85 ADORA2A (0.43) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL25142877 0.84 ALDH1A1 (0.50) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL25143097 0.83 RAB9A (0.47) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL25143582 0.83 RAB9A (0.47) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL25063350 0.83 STAT3 (0.65) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL31665346 0.83 RAB9A (0.47) RAB9ANPC1MEN1KMT2ASMN1; 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
WO-2023061440-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS CULLGEN (SHANGHAI), INC. (CN) 2023-04-20 — — WO disclosed
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