SCHEMBL31444121

SCHEMBL31444121

Brc1cccc(-c2c[nH]cn2)c1.O=S(=O)(O)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.42
▸ IDO1 P14902 3/20 0.41
▸ METAP2 P50579 1/20 0.41
▸ RAB9A P51151 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ AURKA O14965 1/20 0.37
▸ HK1 P19367 1/20 0.37
▸ HKDC1 Q2TB90 1/20 0.37
▸ PTGS2 P35354 2/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ KDM1A O60341 1/20 0.36
▸ MAOA P21397 1/20 0.36
▸ RAD51 Q06609 1/20 0.36
▸ NPC1 O15118 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ CSNK2A2 P19784 1/20 0.35
▸ CSNK2B P67870 1/20 0.35

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
SCHEMBL9654274 0.88 IDO1 (0.50) MAOBIDO1METAP2RAB9AHPGD
Trifluoromethanesulfonic Acid SCHEMBL5694233 0.72 PTPN1 (0.39) MAOBRAB9AHPGDALDH1A1SMN1; SMN2
SCHEMBL12781975 0.72 IDO1 (0.50) MAOBIDO1ALDH1A1KDM4EGAA
SCHEMBL1501914 0.72 HSD17B1 (0.58) METAP2
SCHEMBL1502415 0.72 IDO1 (0.50) MAOBIDO1SMN1; SMN2MAPTKDM4E
SCHEMBL1759307 0.71 KMO (0.53) RAB9AHPGDALDH1A1SMN1; SMN2NPC1
Hydrochloric Acid SCHEMBL1502412 0.70 KMO (0.51) RAB9AHPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL12647571 0.70 MAP4K4 (0.49) AURKACSNK2A1MEN1KMT2A
SCHEMBL16432780 0.70 CCNT1 (0.49) AURKAKDM1ACSNK2A1MAPK1
SCHEMBL15834061 0.70 IDO1 (0.51) IDO1METAP2RAB9AALDH1A1SMN1; 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-2025096856-A1 COVALENT CEREBLON LIGANDS C4 THERAPEUTICS, INC. (US) 2025-05-08 — — WO disclosed
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