SCHEMBL31753690

SCHEMBL31753690

COC(OC)C1CN(c2ccc(C#N)cc2)C1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.48
KDM4E B2RXH2 1/20 0.44
TP53 P04637 1/20 0.44
CHRNA10 Q9GZZ6 1/20 0.41
CHRNA9 Q9UGM1 1/20 0.41
KCNH2 Q12809 2/20 0.39
GRIA2 P42262 1/20 0.39
HTR7 P34969 1/20 0.38
TMEM97 Q5BJF2 1/20 0.38
EGLN2 Q96KS0 1/20 0.38
ELANE P08246 1/20 0.36
POLB P06746 1/20 0.36
CHEK1 O14757 1/20 0.36
GRM2 Q14416 1/20 0.36

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
SCHEMBL31752430 0.84 CHRNA10 (0.49) HRH3KDM4ETP53CHRNA10CHRNA9
SCHEMBL23261764 0.81 HRH3 (0.51) HRH3KDM4ETP53CHRNA10CHRNA9
SCHEMBL29148153 0.80 IGF1R (0.38) HRH3POLB
SCHEMBL30646315 0.78 MAPT (0.43) KDM4ETP53HTR7POLBGRM2
SCHEMBL19570981 0.75 HRH3 (0.55) HRH3KDM4ETP53CHRNA10CHRNA9
SCHEMBL1481831 0.75 HRH3 (0.55) HRH3KDM4ETP53CHRNA10CHRNA9
Hydrochloric Acid SCHEMBL1482412 0.73 HRH3 (0.54) HRH3KDM4ETP53CHRNA10CHRNA9
SCHEMBL21891921 0.73 HRH3 (0.54) HRH3KDM4ETP53CHRNA10CHRNA9
SCHEMBL24319287 0.72 KDM4E (0.41) KDM4EPOLB
SCHEMBL31752769 0.72 CHRNA7 (0.43) HRH3CHRNA10CHRNA9POLBCHEK1

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-2025262297-A1 PROTAC DEGRADERS OF MLLT1 AND/OR MLLT3 DARK BLUE THERAPEUTICS LTD (GB) 2025-12-26 WO disclosed