SCHEMBL23944462

SCHEMBL23944462

C=CCN(c1c(-c2c(C)cc(C#N)cc2F)c(Cl)nc2ncnn12)[C@H](C)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 8/20 0.39
PDE2A O00408 1/20 0.31
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
TSHR P16473 1/20 0.30
KMT2A Q03164 1/20 0.30

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 0.92 EGLN2 (0.40) EGLN2PDE2AALDH1A1POLBTSHR
SCHEMBL23944159 0.91 EGLN2 (0.39) EGLN2PDE2A
SCHEMBL23943836 0.89
SCHEMBL23944460 0.88 ALDH1A1 (0.31) ALDH1A1POLBTSHRKMT2A
SCHEMBL23943833 0.86
SCHEMBL23943823 0.84 EGLN2 (0.31) EGLN2ALDH1A1POLBTSHRKMT2A
SCHEMBL22644287 0.81 KMT2A (0.33) ALDH1A1POLBTSHRKMT2A
SCHEMBL22644286 0.81 KMT2A (0.33) ALDH1A1POLBTSHRKMT2A
SCHEMBL23943838 0.81
SCHEMBL23944154 0.80 EGLN2 (0.45) EGLN2PDE2AALDH1A1POLBTSHR

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