SCHEMBL28891198

SCHEMBL28891198

CCCCOc1ccccc1-c1ccc(-c2cc(C(=O)O)c3cc(F)ccc3n2)cc1C

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 8/20 0.57
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ EIF4A1 P60842 2/20 0.51
▸ PDE10A Q9Y233 4/20 0.50
▸ PLA2G2A P14555 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.47
▸ GAA P10253 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ PTPN11 Q06124 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ RAB9A P51151 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
SCHEMBL28891179 0.93 DHODH (0.55) DHODHMEN1KMT2AEIF4A1PDE10A
SCHEMBL28891171 0.92 DHODH (0.58) DHODHMEN1KMT2AEIF4A1PDE10A
SCHEMBL28891208 0.92 DHODH (0.60) DHODHMEN1KMT2APDE10APLA2G2A
SCHEMBL28885855 0.90 DHODH (0.65) DHODHMEN1KMT2AEIF4A1PDE10A
SCHEMBL28885856 0.88 DHODH (0.61) DHODHMEN1KMT2AEIF4A1PDE10A
SCHEMBL28891175 0.86 DHODH (0.55) DHODHMEN1KMT2AEIF4A1PDE10A
SCHEMBL23579598 0.86 DHODH (0.66) DHODHMEN1KMT2AEIF4A1PDE10A
SCHEMBL29996591 0.86 DHODH (0.66) DHODHMEN1KMT2AEIF4A1PDE10A
SCHEMBL28891192 0.85 DHODH (0.53) DHODHMEN1KMT2AEIF4A1PDE10A
SCHEMBL28891182 0.85 DHODH (0.53) DHODHMEN1KMT2AEIF4A1PDE10A

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-115361948-A Methods and compositions for inhibiting dihydroorotate dehydrogenase 俄亥俄州国家创新基金会 2022-11-18 — — CN disclosed
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