SCHEMBL30890876

SCHEMBL30890876

Cc1nc(N)ccc1Oc1ccnc(NC(=O)C2CCN(C)CC2)c1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.53
BRAF P15056 8/20 0.51
CSF1R P07333 4/20 0.48
PDGFRA P16234 4/20 0.48
PDGFRB P09619 3/20 0.48
FLT3 P36888 1/20 0.47
ABL1 P00519 1/20 0.46
GSK3B P49841 1/20 0.46
DYRK1A Q13627 1/20 0.46

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
SCHEMBL21426332 1.00 KDR (0.53) KDRBRAFCSF1RPDGFRAPDGFRB
SCHEMBL16036678 0.93 KDR (0.52) KDRBRAF
SCHEMBL16037120 0.86 CSF1R (0.44) KDRBRAFCSF1RPDGFRAPDGFRB
SCHEMBL21772037 0.85 KDR (0.51) KDRBRAFCSF1RPDGFRAPDGFRB
SCHEMBL16038352 0.83 TGFBR1 (0.48) CSF1RPDGFRAPDGFRB
SCHEMBL16037156 0.82 KDR (0.56) KDRBRAFABL1GSK3BDYRK1A
SCHEMBL16059181 0.82 CSF1R (0.55) KDRBRAFCSF1RPDGFRAPDGFRB
SCHEMBL16037333 0.82 CSF1R (0.45) CSF1RPDGFRAPDGFRB
SCHEMBL21425751 0.80 KDR (0.49) KDRBRAFCSF1RPDGFRAPDGFRB
SCHEMBL21425524 0.80 CSF1R (0.66) KDRBRAFCSF1RPDGFRAPDGFRB

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-3632907-B1 N-(AZAARYL)CYCLOLACTAM-1-CARBOXAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF ABBISKO THERAPEUTICS CO LTD (CN) 2024-02-28 EP disclosed