SCHEMBL29348791

SCHEMBL29348791

Cc1ccc(N2C(=O)CCCC23CC3)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
MAPT P10636 3/20 0.40
HTT P42858 1/20 0.40
LMNA P02545 1/20 0.39
ELANE P08246 2/20 0.38
F2 P00734 1/20 0.38
CTSG P08311 1/20 0.38
CMA1 P23946 1/20 0.38
CTRC Q99895 1/20 0.38
ALOX5 P09917 1/20 0.38
ALDH1A1 P00352 4/20 0.37
GLA P06280 1/20 0.37
TP53 P04637 1/20 0.37
MGLL Q99685 1/20 0.36
MEN1 O00255 1/20 0.36
PABPC1 P11940 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MMP13 P45452 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
SCHEMBL29348907 0.83 LMNA (0.42) POLBMAPTHTTLMNAELANE
SCHEMBL29348792 0.83 FAAH (0.36) POLBALDH1A1MGLLKMT2AMMP13
SCHEMBL29348793 0.83 MMP13 (0.53) POLBALDH1A1MGLLKMT2AMMP13
SCHEMBL29348818 0.79 KMT2A (0.53) POLBMAPTALDH1A1MGLLTSHR
SCHEMBL8305604 0.75 HTT (0.45) POLBMAPTHTTLMNAELANE
SCHEMBL29348817 0.73 ALDH1A1 (0.41) POLBLMNAALDH1A1MMP13
SCHEMBL24253818 0.73 MMP13 (0.44) MAPTHTTLMNAALOX5ALDH1A1
SCHEMBL29349005 0.72 MMP13 (0.56) POLBALDH1A1MGLLMMP13
SCHEMBL29348930 0.71 MMP13 (0.59) POLBALDH1A1MGLLMMP13
SCHEMBL29348913 0.71 KMT2A (0.47) POLBMAPTALDH1A1MGLLTSHR

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-2024151547-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS, INC. (US) 2024-07-18 WO disclosed