3-Chloroaniline

3-Chloroaniline

SCHEMBL8308008

Clc1cccc(Nc2nccc(-c3ccc(N4CCNCC4)nc3)n2)c1.Nc1cccc(Cl)c1

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 6/20 0.68
ZAP70 P43403 6/20 0.59
PRKCA P17252 2/20 0.59
PRKCD Q05655 2/20 0.59
EGFR P00533 2/20 0.59
PRKD3 O94806 1/20 0.59
PRKCG P05129 1/20 0.59
PRKCB P05771 1/20 0.59
LCK P06239 1/20 0.59
PRKCH P24723 1/20 0.59
PRKCI P41743 1/20 0.59
PRKCE Q02156 1/20 0.59
PRKCQ Q04759 1/20 0.59
PRKCZ Q05513 1/20 0.59
PRKD1 Q15139 1/20 0.59
CDK1 P06493 1/20 0.55
CDK2 P24941 1/20 0.55
SMG1 Q96Q15 1/20 0.55
ABL1 P00519 3/20 0.54
BCR P11274 3/20 0.54

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
SCHEMBL6947468 0.94 CAMK2D (0.72) CAMK2DZAP70PRKCAPRKCDEGFR
3-Nitroaniline SCHEMBL8300936 0.84 ABL1 (0.57) CAMK2DZAP70PRKCAPRKCDEGFR
SCHEMBL6957800 0.84 ZAP70 (0.66) CAMK2DZAP70PRKCAPRKCDEGFR
SCHEMBL8306459 0.83 ZAP70 (0.56) CAMK2DZAP70PRKCAPRKCDEGFR
SCHEMBL6955195 0.83 ZAP70 (0.67) CAMK2DZAP70PRKCAPRKCDEGFR
SCHEMBL6952728 0.83 ZAP70 (0.65) CAMK2DZAP70PRKCAPRKCDEGFR
SCHEMBL6109641 0.83 SMG1 (0.78) CAMK2DPRKCAPRKCDCDK1CDK2
SCHEMBL6955286 0.83 ZAP70 (0.66) CAMK2DZAP70PRKCAPRKCDEGFR
SCHEMBL6952360 0.83 ZAP70 (0.68) CAMK2DZAP70PRKCAPRKCDEGFR
SCHEMBL6957131 0.81 ZAP70 (0.62) CAMK2DZAP70PRKCAPRKCDEGFR

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