SCHEMBL23944154

SCHEMBL23944154

Cc1cc(C#N)cc(F)c1-c1c(Cl)nc2ncnn2c1N(C)[C@H](C)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 16/20 0.45
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
GFER P55789 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PDE2A O00408 2/20 0.33
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL23943822 0.85 EGLN2 (0.40) EGLN2ALDH1A1KMT2AMEN1GAA
SCHEMBL4814284 0.83 ENPP1 (0.35) ALDH1A1KMT2AMEN1GAAPDE2A
SCHEMBL23944462 0.80 EGLN2 (0.39) EGLN2ALDH1A1KMT2APDE2APOLB
SCHEMBL23944159 0.80 EGLN2 (0.39) EGLN2PDE2A
SCHEMBL4820773 0.79 ENPP1 (0.35) ALDH1A1KMT2AMEN1GAAPOLB
SCHEMBL23943830 0.77 EGLN2 (0.30) EGLN2ALDH1A1KMT2APOLBTSHR
SCHEMBL23943823 0.76 EGLN2 (0.31) EGLN2ALDH1A1KMT2APOLBTSHR
SCHEMBL4820523 0.74 ENPP1 (0.36) ALDH1A1KMT2AMEN1GAAGFER
SCHEMBL23925484 0.73 EGLN2 (0.48) EGLN2ALDH1A1KMT2APOLBTSHR
SCHEMBL23944197 0.73 EGLN2 (0.40) EGLN2ALDH1A1KMT2AMEN1GAA

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
WO-2021211408-A1 SUBSTITUTED {1,2,4,} TRIAZOLO{1,5-A} PYRIMIDINE COMPOUNDS AND USE IN STABILIZING MICROTUBULES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2021-10-21 WO disclosed