SCHEMBL22650436

SCHEMBL22650436

Fc1cnc(Cl)nc1-c1ccn2ncc(Br)c2c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RPS6KA5 O75582 2/20 0.34
BTK Q06187 1/20 0.32
SCN5A Q14524 1/20 0.31
MAPT P10636 1/20 0.31
ABL1 P00519 1/20 0.31
BCR P11274 1/20 0.31
POLB P06746 1/20 0.30
CASP6 P55212 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
EPHB3 P54753 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
SCHEMBL22650356 0.81 SCN5A (0.39) RPS6KA5SCN5ASMN1; SMN2
SCHEMBL22650740 0.81 RPS6KA5 (0.32) RPS6KA5SMN1; SMN2
SCHEMBL22650908 0.80 CAMKK1 (0.38) RPS6KA5SCN5AMAPTPOLBCASP6
SCHEMBL22650437 0.76 SCN5A (0.42) RPS6KA5BTKSCN5AMAPTPOLB
SCHEMBL22650698 0.74 MAPK14 (0.35)
SCHEMBL13120752 0.71 BIRC5 (0.42) BTKMAPTSMN1; SMN2
SCHEMBL20356475 0.70 RPS6KA5 (0.35) RPS6KA5SMN1; SMN2
SCHEMBL3313922 0.69 DYRK1A (0.47) RPS6KA5MAPTEPHB3
SCHEMBL26682145 0.69 EPHB3 (0.43) POLBSMN1; SMN2EPHB3
SCHEMBL412313 0.68 AHR (0.43) MAPT

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-2020224568-A1 CDK INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2020-11-12 WO disclosed