SCHEMBL8154100

SCHEMBL8154100

CCc1nc2cc(Nc3nccc(-c4ccc(N5CCN(CC)CC5)nc4)n3)ccc2o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ZAP70 P43403 11/20 0.61
▸ CCNT1 O60563 2/20 0.48
▸ CDK9 P50750 2/20 0.48
▸ PRKD3 O94806 2/20 0.46
▸ PRKCG P05129 2/20 0.46
▸ PRKCB P05771 2/20 0.46
▸ LCK P06239 2/20 0.46
▸ PRKCA P17252 2/20 0.46
▸ PRKCH P24723 2/20 0.46
▸ PRKCI P41743 2/20 0.46
▸ PRKCE Q02156 2/20 0.46
▸ PRKCQ Q04759 2/20 0.46
▸ PRKCZ Q05513 2/20 0.46
▸ PRKCD Q05655 2/20 0.46
▸ PRKD1 Q15139 2/20 0.46
▸ EGFR P00533 1/20 0.46
▸ PIK3C3 Q8NEB9 1/20 0.43
▸ MYLK4 Q86YV6 1/20 0.42
▸ CLK4 Q9HAZ1 1/20 0.42
▸ STK17A Q9UEE5 1/20 0.42

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
SCHEMBL8149363 0.90 ZAP70 (0.59) ZAP70CCNT1CDK9PRKD3PRKCG
SCHEMBL8153192 0.83 BRAF (0.46) ZAP70CCNT1CDK9PRKD3PRKCG
SCHEMBL6956773 0.76 ZAP70 (1.00) ZAP70CDK9PRKD3PRKCGPRKCB
SCHEMBL6957436 0.71 ZAP70 (0.66) ZAP70PRKD3PRKCGPRKCBLCK
SCHEMBL8154077 0.69 ZAP70 (0.61) ZAP70CCNT1CDK9PRKD3PRKCG
SCHEMBL6956423 0.69 ZAP70 (0.68) ZAP70PRKD3PRKCGPRKCBLCK
SCHEMBL8148269 0.69 ZAP70 (0.62) ZAP70CCNT1CDK9PRKD3PRKCG
SCHEMBL8139875 0.69 ZAP70 (0.62) ZAP70CCNT1CDK9PRKD3PRKCG
SCHEMBL609202 0.67 IKBKB (0.69) ZAP70PRKD3PRKCGPRKCBLCK
SCHEMBL6956788 0.67 ZAP70 (0.82) ZAP70CDK9PRKD3PRKCGPRKCB

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-6093716-A Substituted 2-pyrimidineamines and processes for their preparation CELLTECH THERAPEUTICS, LIMITED (GB) 2000-07-25 — — US disclosed
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