SCHEMBL20097955

SCHEMBL20097955

CC1CC1C(=O)Nc1cccc(Nc2nccc(Nc3cccc(C(F)(F)F)c3)n2)c1

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 17/20 0.77
▸ LCK P06239 1/20 0.77
▸ IGF1R P08069 1/20 0.77
▸ EIF2AK2 P19525 1/20 0.77
▸ SYK P43405 1/20 0.77
▸ BMX P51813 1/20 0.77
▸ MAPK8 P45983 1/20 0.57
▸ EGFR P00533 1/20 0.55
▸ ERBB4 Q15303 1/20 0.55
▸ ITK Q08881 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
SCHEMBL13777946 0.87 AURKA (1.00) AURKALCKIGF1REIF2AK2SYK
Anilinopyrimidine1 SCHEMBL676556 0.87 AURKA (1.00) AURKALCKIGF1REIF2AK2SYK
SCHEMBL27075735 0.78 AURKA (0.66) AURKALCKIGF1REIF2AK2SYK
SCHEMBL3694508 0.77 AURKA (1.00) AURKALCKIGF1REIF2AK2SYK
SCHEMBL4237476 0.77 AURKA (1.00) AURKALCKIGF1REIF2AK2SYK
SCHEMBL3694510 0.74 AURKA (0.85) AURKALCKIGF1REIF2AK2SYK
SCHEMBL4237478 0.74 AURKA (0.85) AURKALCKIGF1REIF2AK2SYK
SCHEMBL2158639 0.74 AURKA (0.64) AURKALCKIGF1REIF2AK2SYK
SCHEMBL242230 0.71 EGFR (1.00) AURKALCKIGF1REIF2AK2SYK
SCHEMBL19966813 0.71 ABL1 (0.59) AURKALCKIGF1REIF2AK2SYK

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-9957484-B2 Methods for promoting cell reprogramming SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2018-05-01 — — US disclosed
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