SCHEMBL8098939

SCHEMBL8098939

COc1ccc(-c2cn(C3CCNCC3)c3ncnc(N)c23)cc1

nearest known ligand 0.88

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 10/20 0.88
▸ EGFR P00533 6/20 0.82
▸ ABL1 P00519 5/20 0.82
▸ ABL2 P42684 5/20 0.82
▸ RIPK2 O43353 8/20 0.78
▸ LCK P06239 3/20 0.77
▸ TEK Q02763 2/20 0.77
▸ KDR P35968 1/20 0.64
▸ FGR P09769 1/20 0.63
▸ EPHA1 P21709 1/20 0.63
▸ TXK P42681 1/20 0.63
▸ FRK P42685 1/20 0.63
▸ PTK6 Q13882 1/20 0.63

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
Hydrochloric Acid SCHEMBL8114119 0.93 SRC (0.98) SRCEGFRABL1ABL2RIPK2
SCHEMBL8098925 0.88 SRC (0.89) SRCEGFRABL1ABL2LCK
SCHEMBL6465227 0.87 SRC (1.00) SRCEGFRABL1LCKTEK
Hydrochloric Acid SCHEMBL6465660 0.86 SRC (0.98) SRCEGFRABL1LCKTEK
SCHEMBL7020106 0.85 SRC (0.87) SRCEGFRABL1ABL2RIPK2
SCHEMBL13020337 0.85 SRC (0.72) SRCEGFRABL1ABL2RIPK2
SCHEMBL27397203 0.84 SRC (0.67) SRCEGFRABL1ABL2RIPK2
Hydrochloric Acid SCHEMBL7098308 0.84 SRC (0.85) SRCEGFRABL1ABL2RIPK2
SCHEMBL7019630 0.83 SRC (0.81) SRCEGFRABL1ABL2RIPK2
SCHEMBL16752225 0.82 SRC (0.89) SRCEGFRABL1LCKTEK

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
US-6051577-A TYROSINE INHIBITORS; BONE DISORDERS NOVARTIS AG (CH) 2000-04-18 — — US disclosed
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