SCHEMBL28848765

SCHEMBL28848765

O=C(OCCF)N1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
POLB P06746 3/20 0.42
SMN1; SMN2 Q16637 4/20 0.40
LMNA P02545 2/20 0.40
ATM Q13315 2/20 0.39
THRB P10828 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HSD11B1 P28845 1/20 0.38
TSHR P16473 1/20 0.37
HTT P42858 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
CNR2 P34972 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34

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
SCHEMBL29261360 0.98 POLB (0.41) ALDH1A1POLBSMN1; SMN2LMNAATM
SCHEMBL14999309 0.85 ALDH1A1 (0.44) ALDH1A1POLBSMN1; SMN2LMNAATM
SCHEMBL17093002 0.84 SMN1; SMN2 (0.46) ALDH1A1POLBSMN1; SMN2LMNAATM
SCHEMBL21670363 0.83 ALDH1A1 (0.42) ALDH1A1POLBSMN1; SMN2LMNAATM
SCHEMBL22978725 0.83 ALDH1A1 (0.45) ALDH1A1POLBSMN1; SMN2LMNAATM
SCHEMBL16684932 0.83 POLB (0.42) ALDH1A1POLBSMN1; SMN2LMNAATM
SCHEMBL13034371 0.82 ALDH1A1 (0.42) ALDH1A1POLBSMN1; SMN2LMNAATM
SCHEMBL27721600 0.82 SMN1; SMN2 (0.46) ALDH1A1POLBSMN1; SMN2LMNAATM
SCHEMBL16965305 0.80 POLB (0.52) ALDH1A1POLBSMN1; SMN2LMNAATM
SCHEMBL20293774 0.80 ALDH1A1 (0.42) ALDH1A1POLBSMN1; SMN2ATMTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025244956-A1 METHODS OF MANUFACTURING DANICAMTIV MyoKardia, Inc. (US) 2025-11-27 WO disclosed
CN-105073741-B Phthalazinones and isoquinolinones as ROCK inhibitors 百时美施贵宝公司 2017-08-08 CN disclosed