SCHEMBL27334977

SCHEMBL27334977

O=C(OCc1ccccc1)c1ccc2oc(Br)nc2c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.50
▸ NPC1 O15118 6/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ LMNA P02545 3/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ SLC6A2 P23975 1/20 0.50
▸ SLC6A3 Q01959 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ TSHR P16473 1/20 0.49
▸ HPGD P15428 2/20 0.48
▸ MAPT P10636 3/20 0.48
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HDAC6 Q9UBN7 5/20 0.46

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
SCHEMBL20952174 0.77 MAPT (0.56) RAB9ANPC1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL27334960 0.77 CTNNB1 (0.60) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL8717367 0.76 KMT2A (0.55) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL25253664 0.76 HDAC6 (0.48) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL29502366 0.76 HDAC6 (0.48) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL24073353 0.76 RAB9A (0.46) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL2244369 0.76 KMT2A (0.58) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL8712740 0.75 KMT2A (0.54) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL19914214 0.75 RAF1 (0.57) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL6002245 0.75 KMT2A (0.70) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA

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
WO-2024097355-A1 DEUBIQUITINASE-TARGETING CHIMERAS AND RELATED METHODS VICINITAS THERAPEUTICS, INC. (US) 2024-05-10 — — WO disclosed
WO-2024097355-A1 DEUBIQUITINASE-TARGETING CHIMERAS AND RELATED METHODS VICINITAS THERAPEUTICS, INC. (US) 2024-05-10 — — WO disclosed
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