SCHEMBL22497722

SCHEMBL22497722

Cc1noc(C)c1OB(Oc1c(C)noc1C)Oc1c(C)noc1C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.33
BRD2 P25440 1/20 0.33
LMNA P02545 2/20 0.32
GAA P10253 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ERN1 O75460 1/20 0.30

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
SCHEMBL2198294 0.82 LMNA (0.32) BRD4BRD2LMNAGAASMN1; SMN2
SCHEMBL13873247 0.75
SCHEMBL435924 0.71 BRD4 (0.33) BRD4BRD2LMNAGAASMN1; SMN2
SCHEMBL27439659 0.68 BRD4 (0.38) BRD4BRD2ERN1
Hydrochloric Acid SCHEMBL27294572 0.68 CYP1A2 (0.34) BRD4BRD2LMNA
SCHEMBL3417324 0.67 GAA (0.37) BRD4BRD2LMNAGAA
SCHEMBL8394520 0.66 MAPT (0.39) BRD4BRD2LMNAGAA
SCHEMBL18250371 0.63
SCHEMBL27925912 0.63 ELANE (0.36) BRD4GAA
SCHEMBL6569258 0.62 CACNA1F (0.48) BRD4BRD2LMNASMN1; 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
WO-2020200284-A1 PREPARATION METHOD FOR TRICYCLIC COMPOUND AND USE OF SAME IN FIELD OF MEDICINE 上海华汇拓医药科技有限公司 2020-10-08 WO disclosed