SCHEMBL27603096

SCHEMBL27603096

CC(Nc1ncnc2[nH]c(-c3ccc(CN4CCCCC4)cc3)cc12)c1ccccc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.84
KDR P35968 6/20 0.84
ERBB2 P04626 4/20 0.84
STK10 O94804 1/20 0.84
MAP4K4 O95819 1/20 0.84
ABL1 P00519 1/20 0.84
YES1 P07947 1/20 0.84
RET P07949 1/20 0.84
PDGFRB P09619 1/20 0.84
BCR P11274 1/20 0.84
FLT1 P17948 1/20 0.84
ERBB3 P21860 1/20 0.84
WEE1 P30291 1/20 0.84
ABL2 P42684 1/20 0.84
NEK3 P51956 1/20 0.84
LIMK1 P53667 1/20 0.84
LIMK2 P53671 1/20 0.84
EPHB4 P54760 1/20 0.84
ACVR1 Q04771 1/20 0.84
TNK2 Q07912 1/20 0.84

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
SCHEMBL4769926 1.00 EGFR (0.84) EGFRKDRERBB2STK10MAP4K4
SCHEMBL27585261 0.99 EGFR (0.86) EGFRKDRERBB2STK10MAP4K4
SCHEMBL4767093 0.99 EGFR (0.86) EGFRKDRERBB2STK10MAP4K4
SCHEMBL93737 0.92 EGFR (0.86) EGFRKDRERBB2STK10MAP4K4
SCHEMBL4765908 0.92 EGFR (0.71) EGFRKDRERBB2STK10MAP4K4
SCHEMBL4896590 0.92 EGFR (0.83) EGFRKDRERBB2STK10MAP4K4
Aee-788 SCHEMBL29478848 0.92 EGFR (1.00) EGFRKDRERBB2STK10MAP4K4
Aee-788 SCHEMBL1738023 0.92 EGFR (1.00) EGFRKDRERBB2STK10MAP4K4
SCHEMBL93738 0.92 EGFR (0.86) EGFRKDRERBB2STK10MAP4K4
Aee-788 SCHEMBL29389001 0.92 EGFR (1.00) EGFRKDRERBB2STK10MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101560214-A 4-amino-6-phenyl-pyrrolo[2, 3-d]pyrimidine derivatives NOVARTIS AG (CH) 2009-10-21 CN claimed
CN-1538847-A 4-amino-6-phenyl-pyrrolo [2, 3-d ] pyrimidine derivatives ��˹��ŵ�� 2004-10-20 CN claimed
CN-101560214-B 4-amino-6-phenyl-pyrrolo[2, 3-d]pyrimidine derivatives NOVARTIS AG 2011-05-25 CN disclosed
CN-101560214-A 4-amino-6-phenyl-pyrrolo[2, 3-d]pyrimidine derivatives NOVARTIS AG (CH) 2009-10-21 CN disclosed
CN-1538847-A 4-amino-6-phenyl-pyrrolo [2, 3-d ] pyrimidine derivatives ��˹��ŵ�� 2004-10-20 CN disclosed