SCHEMBL11834715

SCHEMBL11834715

CCC(N(C)C)n1nc(-c2ccccc2)c2cc(Br)ccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.50
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ DCLK1 O15075 1/20 0.38
▸ PRKD3 O94806 1/20 0.38
▸ MAP4K4 O95819 1/20 0.38
▸ CHEK2 O96017 1/20 0.38
▸ CSF1R P07333 1/20 0.38
▸ FER P16591 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ MARK3 P27448 1/20 0.38
▸ FLT4 P35916 1/20 0.38
▸ FLT3 P36888 1/20 0.38
▸ MAPK9 P45984 1/20 0.38
▸ CSNK1D P48730 1/20 0.38
▸ CLK2 P49760 1/20 0.38
▸ CSNK2A1 P68400 1/20 0.38
▸ CSNK1G2 P78368 1/20 0.38
▸ MAP4K2 Q12851 1/20 0.38

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
SCHEMBL11838053 0.86 KDM4E (0.51) KDM4EKMT2AMEN1TSHRMAPT
SCHEMBL11842018 0.85 KDM4E (0.69) KDM4EKMT2AMEN1TSHRMAPT
SCHEMBL11834582 0.84 KMT2A (0.55) KDM4EKMT2ATSHRMAPTLMNA
Hydrochloric Acid SCHEMBL11837379 0.84 KDM4E (0.67) KDM4EKMT2AMEN1TSHRMAPT
Hydrochloric Acid SCHEMBL11833084 0.83 KMT2A (0.53) KDM4EKMT2ATSHRMAPTLMNA
SCHEMBL11669095 0.82 KDM4E (0.56) KDM4EKMT2AMEN1TSHRMAPT
Oxalic Acid SCHEMBL11843237 0.81 KDM4E (0.55) KDM4EKMT2AMEN1TSHRMAPT
SCHEMBL11835514 0.76 KDM4E (0.50) KDM4EKMT2AMEN1TSHRMAPT
Hydrochloric Acid SCHEMBL11835491 0.75 KDM4E (0.49) KDM4EKMT2AMEN1TSHRMAPT
SCHEMBL4499277 0.73 L3MBTL1 (0.59) KDM4EKMT2AMEN1DCLK1PRKD3

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
US-3994890-A TRANQUILIZERS, ANTIDEPRESSANTS, ANTIINFLAMMATORY CHUGAI SEIYAKU KABUSHIKI KAISHA (JA) 1976-11-30 — — US claimed
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