SCHEMBL14069576

SCHEMBL14069576

Cc1cn(-c2cc(C(=O)Nc3ccc(C)c(Nc4nn(C)c5nc(NCCCCN(C)C)ncc45)c3)cc(C(F)(F)F)c2)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 2/20 0.51
▸ BTK Q06187 3/20 0.51
▸ MAPT P10636 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ BRAF P15056 5/20 0.49
▸ ABL1 P00519 8/20 0.47
▸ BCR P11274 6/20 0.47
▸ TNK2 Q07912 1/20 0.47
▸ MAP4K2 Q12851 1/20 0.47
▸ LCK P06239 3/20 0.47
▸ LYN P07948 3/20 0.47
▸ HCK P08631 3/20 0.47
▸ SRC P12931 3/20 0.47
▸ FYN P06241 2/20 0.47
▸ YES1 P07947 2/20 0.47
▸ PDGFRA P16234 2/20 0.47
▸ FRK P42685 2/20 0.47
▸ EGFR P00533 1/20 0.47

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
SCHEMBL14070219 0.91 BTK (0.56) BTKBRAFLCKLYNHCK
SCHEMBL14070214 0.87 BRAF (0.56) CSF1RBTKBRAFLCKLYN
SCHEMBL14070080 0.87 BRAF (0.56) CSF1RBTKBRAFLCKLYN
SCHEMBL14070189 0.87 BTK (0.65) CSF1RBTKRECQLBRAFABL1
SCHEMBL14069583 0.84 CSF1R (0.58) CSF1RBTKMAPTKDM4EPOLB
SCHEMBL14069750 0.84 BTK (0.53) BTKBRAFLCKLYNHCK
SCHEMBL14069575 0.84 BTK (0.48) BTKBRAFLCKLYNHCK
SCHEMBL14069863 0.83 BTK (0.58) BTKMAPTPOLBRECQLBRAF
SCHEMBL14069748 0.82 BTK (0.47) BTKBRAFLCKLYNHCK
SCHEMBL14070218 0.82 CSF1R (0.53) CSF1RBTKBRAFLCKLYN

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-2008112695-A2 PYRAZOLO [3,4-D] PYRIMIDINES AND 1, 2, 5, 6-TETRAAZA- AS- INDACENES AS PROTEIN KINASE INHIBITORS FOR CANCER TREATMENT IRM LLC (BM) 2008-09-18 — — WO disclosed
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