SCHEMBL7465982

SCHEMBL7465982

c1ccc(-c2ccnc(Nc3cccc4ccccc34)n2)nc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.50
TYRO3 Q06418 1/20 0.50
MERTK Q12866 1/20 0.50
GAS6 Q14393 1/20 0.50
ABL1 P00519 1/20 0.50
BCR P11274 1/20 0.50
PRKCA P17252 1/20 0.50
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
ALPL P05186 1/20 0.49
HSP90AA1 P07900 1/20 0.49
ALPI P09923 1/20 0.49
ALPG P10696 1/20 0.49
ALOX15 P16050 1/20 0.49
MAPK1 P28482 1/20 0.49
CCR1 P32246 1/20 0.49
HTT P42858 1/20 0.49
CCR5 P51681 1/20 0.49
CCR8 P51685 1/20 0.49

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
SCHEMBL27542221 0.82 PLAU (0.58) KDM4ETP53ALOX15MAPK1SMN1; SMN2
SCHEMBL7467181 0.81 ABL1 (0.54) FLT3ABL1BCRPRKCAKDM4E
SCHEMBL28654499 0.78 ULK1 (0.50) FLT3TYRO3MERTKGAS6KDM4E
SCHEMBL7470857 0.76 ABL1 (0.63) ABL1BCRPRKCAMAPK1SMN1; SMN2
SCHEMBL2819228 0.76 CDK4 (0.54) ABL1BCRPRKCAKDM4ELMNA
SCHEMBL4825274 0.76 BRD4 (0.47) FLT3ABL1PRKCACCNB2CDK1
SCHEMBL2994968 0.75 AURKA (0.62) ABL1BCRPRKCAMAPK1SYK
SCHEMBL15158474 0.75 ATM (0.57) FLT3TYRO3MERTKGAS6KDM4E
SCHEMBL3756370 0.74 IKBKB (0.53) FLT3TYRO3ABL1SYK
SCHEMBL6545045 0.74 ULK1 (0.55) KDM4ELMNATP53ALOX15MAPK1

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-0233461-B2 4,5,6-Substituted-2-pyrimidinamines AMERICAN CYANAMID CO (US) 2002-05-29 EP claimed
EP-0233461-B1 4,5,6-Substituted-2-pyrimidinamines AMERICAN CYANAMID CO (US) 1996-03-20 EP claimed