SCHEMBL9903261

SCHEMBL9903261

CC1(C)CC(NC(=N)Nc2ccc(Br)cc2)CC(C)(C)N1O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.42
▸ GAA P10253 2/20 0.42
▸ KMT2A Q03164 3/20 0.40
▸ RAB9A P51151 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ EPHX1 P07099 1/20 0.38
▸ FPR2 P25090 7/20 0.37
▸ FPR3 P25089 2/20 0.37
▸ EPHX2 P34913 1/20 0.36
▸ OPRM1 P35372 1/20 0.36
▸ OPRD1 P41143 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL9902365 0.84 KMT2A (0.39) KDM4EGAAKMT2ASMN1; SMN2MEN1
SCHEMBL9902746 0.84 OPRM1 (0.37) KDM4EKMT2ARAB9ASMN1; SMN2MEN1
SCHEMBL9903243 0.83 KDM4E (0.58) KDM4EGAAKMT2ACA1CA2
SCHEMBL9903032 0.78 RECQL (0.37) KDM4EGAAKMT2ARAB9ASMN1; SMN2
SCHEMBL9902803 0.78 GAA (0.41) KDM4EGAAKMT2ARAB9ASMN1; SMN2
SCHEMBL9902154 0.77 KDM4E (0.38) KDM4EGAAKMT2ARAB9ASMN1; SMN2
SCHEMBL9901731 0.71 KDM4E (0.35) KDM4EGAAKMT2AOPRM1
SCHEMBL9903262 0.71 GRIN2D (0.44) KDM4EGAAKMT2ACA1CA2
SCHEMBL9901606 0.70 FPR2 (0.35) KDM4EGAAKMT2ARAB9ASMN1; SMN2
SCHEMBL9901609 0.70 FPR2 (0.35) KDM4EGAAKMT2ARAB9ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2649048-A1 MULTIFUNCTIONAL NITROXIDE DERIVATIVES AND USES THEREOF Radikal Therapeutics Inc. (US) 2013-10-16 — — EP disclosed
WO-2012077108-A1 MULTIFUNCTIONAL NITROXIDE DERIVATIVES AND USES THEREOF RADIKAL THERAPEUTICS INC. (US) 2012-06-14 — — WO disclosed
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