SCHEMBL8308009

SCHEMBL8308009

Clc1cccc(NN(c2cccc(Cl)c2)c2nccc(-c3ccc(N4CCNCC4)nc3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 2/20 0.49
ZAP70 P43403 6/20 0.48
PRKCA P17252 2/20 0.48
PRKCD Q05655 2/20 0.48
PRKD3 O94806 1/20 0.48
EGFR P00533 1/20 0.48
PRKCG P05129 1/20 0.48
PRKCB P05771 1/20 0.48
LCK P06239 1/20 0.48
PRKCH P24723 1/20 0.48
PRKCI P41743 1/20 0.48
PRKCE Q02156 1/20 0.48
PRKCQ Q04759 1/20 0.48
PRKCZ Q05513 1/20 0.48
PRKD1 Q15139 1/20 0.48
MAOB P27338 1/20 0.41
HTR6 P50406 1/20 0.41
KCNH2 Q12809 1/20 0.41
CACNA1C Q13936 1/20 0.41
ASIC3 Q9UHC3 1/20 0.41

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
SCHEMBL8300938 0.84 ZAP70 (0.46) ZAP70PRKCAPRKCDPRKD3EGFR
SCHEMBL6947468 0.81 CAMK2D (0.72) CAMK2DZAP70PRKCAPRKCDPRKD3
SCHEMBL8306822 0.79 ZAP70 (0.49) ZAP70PRKCAPRKCDPRKD3EGFR
3-Chloroaniline SCHEMBL8308008 0.77 CAMK2D (0.68) CAMK2DZAP70PRKCAPRKCDPRKD3
SCHEMBL6957800 0.72 ZAP70 (0.66) CAMK2DZAP70PRKCAPRKCDPRKD3
SCHEMBL6957229 0.72 ZAP70 (0.53) ZAP70PRKCAPRKCDPRKD3EGFR
SCHEMBL6955286 0.71 ZAP70 (0.66) CAMK2DZAP70PRKCAPRKCDPRKD3
SCHEMBL6952360 0.70 ZAP70 (0.68) CAMK2DZAP70PRKCAPRKCDPRKD3
SCHEMBL6952728 0.70 ZAP70 (0.65) CAMK2DZAP70PRKCAPRKCDPRKD3
SCHEMBL6955195 0.70 ZAP70 (0.67) CAMK2DZAP70PRKCAPRKCDPRKD3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934304-A1 2-PYRIMIDINEAMINE DERIVATIVES AND PROCESSES FOR THEIR PREPARATION CELLTECH THERAPEUTICS LIMITED (GB) 1999-08-11 EP disclosed
WO-1998018782-A1 2-PYRIMIDINEAMINE DERIVATIVES AND PROCESSES FOR THEIR PREPARATION CELLTECH THERAPEUTICS LIMITED (GB) 1998-05-07 WO disclosed