SCHEMBL28891182

SCHEMBL28891182

CCCCOc1ccccc1-c1ccc(-c2cc(C(=O)O)c3cc(F)ccc3n2)c(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 9/20 0.53
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ KDM4E B2RXH2 3/20 0.52
▸ POLB P06746 1/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ EIF4A1 P60842 2/20 0.50
▸ PLA2G2A P14555 2/20 0.49
▸ PDE10A Q9Y233 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 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
SCHEMBL28891183 0.92 PDE10A (0.57) DHODHMEN1KMT2AKDM4EPOLB
SCHEMBL28891175 0.91 DHODH (0.55) DHODHMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL28891179 0.90 DHODH (0.55) DHODHMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL28885855 0.89 DHODH (0.65) DHODHMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL23580009 0.88 DHODH (0.59) DHODHMEN1KMT2AKDM4EPOLB
SCHEMBL29997205 0.88 DHODH (0.59) DHODHMEN1KMT2AKDM4EPOLB
SCHEMBL28885856 0.87 DHODH (0.61) DHODHMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL28891171 0.85 DHODH (0.58) DHODHMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL28891189 0.85 KDM4E (0.62) DHODHMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL28891198 0.85 DHODH (0.57) DHODHMEN1KMT2AKDM4ESMN1; 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
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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