SCHEMBL30439174

SCHEMBL30439174

CCOC(=O)c1cnc2c(-c3cccc(F)c3F)c(OS(=O)(=O)C(F)(F)F)nn2c1C(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ NPC1 O15118 5/20 0.38
▸ RAB9A P51151 5/20 0.38
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ HPGD P15428 3/20 0.38
▸ NFKB1 P19838 2/20 0.38
▸ NFKB2 Q00653 2/20 0.38
▸ RELA Q04206 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ STAT1 P42224 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ POLB P06746 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ PKM P14618 1/20 0.37

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
SCHEMBL20768145 1.00 KDM4E (0.40) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL19464250 0.85 ALDH1A1 (0.41) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL19463668 0.84 ALDH1A1 (0.46) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL19463978 0.84 KDM4E (0.43) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL20768143 0.83 MAPT (0.43) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL19463512 0.83 KDM4E (0.43) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL19464067 0.80 MAPT (0.42) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL28629447 0.72 DHODH (0.38) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL28623585 0.72 DHODH (0.38) KDM4EALDH1A1MAPTKMT2AMEN1
SCHEMBL22461525 0.70 CSNK1D (0.58) KDM4EALDH1A1MAPTKMT2AMEN1

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
EP-3442974-B1 PYRAZOLOPYRIMIDINE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2023-06-07 — — EP disclosed
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