SCHEMBL6314480

SCHEMBL6314480

COc1ccc(Cl)c(-c2cnc(N)nc2Nc2cnc3ccccc3c2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 5/20 0.46
ALPL P05186 5/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CNR2 P34972 1/20 0.46
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
PIK3CA P42336 3/20 0.43
BCL6 P41182 1/20 0.42
PDE2A O00408 1/20 0.41
PDE10A Q9Y233 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
TNF P01375 1/20 0.41
EGFR P00533 1/20 0.40
PDGFRB P09619 1/20 0.40
KDR P35968 1/20 0.40
MTOR P42345 1/20 0.40

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
SCHEMBL6313634 0.89 ALPL (0.49) IGF1RALPLLMNASMN1; SMN2CNR2
SCHEMBL6311387 0.79 IGF1R (0.47) IGF1RALPLLMNASMN1; SMN2KDM4E
SCHEMBL6318985 0.78 PIK3CA (0.46) IGF1RALPLSMN1; SMN2PIK3CABCL6
SCHEMBL6313731 0.77 PIK3CA (0.41) IGF1RALPLPIK3CABCL6TNF
SCHEMBL6318862 0.76 DHFR (0.56) IGF1RKDM4EPIK3CABCL6TNF
SCHEMBL6313711 0.76 PIK3CA (0.41) ALPLLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL6313459 0.76 PIK3CA (0.41) ALPLLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL6315310 0.75 ADORA1 (0.45) IGF1RALPLLMNASMN1; SMN2PIK3CA
SCHEMBL6315288 0.74 PDGFRB (0.49) SMN1; SMN2KDM4EALDH1A1PIK3CABCL6
SCHEMBL6314059 0.73 FYN (0.44) IGF1RALPLLMNASMN1; SMN2ALDH1A1

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-6939874-B2 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. (US) 2005-09-06 US disclosed