SCHEMBL24674803

SCHEMBL24674803

CCCC(=O)NCCOCCOCC(=O)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CASP2 P42575 1/20 0.42
GLP1R P43220 8/20 0.40
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA4 P22748 2/20 0.35
CA9 Q16790 2/20 0.35
CA14 Q9ULX7 2/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL25913029 1.00 MEN1 (0.45) MEN1KMT2ACASP2GLP1RSMN1; SMN2
SCHEMBL19491599 0.89 MEN1 (0.46) MEN1KMT2ACASP2GLP1RSMN1; SMN2
SCHEMBL25976736 0.88 MEN1 (0.45) MEN1KMT2AGLP1RSMN1; SMN2
SCHEMBL22909325 0.87 MEN1 (0.47) MEN1KMT2AGLP1RSMN1; SMN2
SCHEMBL25546664 0.87 MEN1 (0.47) MEN1KMT2AGLP1RSMN1; SMN2
SCHEMBL24700122 0.87 CASP2 (0.44) MEN1KMT2ACASP2SMN1; SMN2ALDH1A1
SCHEMBL22526369 0.87 MEN1 (0.47) MEN1KMT2AGLP1RSMN1; SMN2
SCHEMBL24673572 0.87 CASP2 (0.54) CASP2GLP1R
SCHEMBL10048529 0.85 CASP2 (0.55) MEN1KMT2ACASP2CA12CA1
SCHEMBL24470294 0.84 MEN1 (0.45) MEN1KMT2AGLP1RSMN1; SMN2

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-2022159688-A9 DEGRADERS OF GRK2 AND USES THEREOF SONATA THERAPEUTICS, INC. (US) 2023-09-21 WO disclosed
WO-2022159688-A1 DEGRADERS OF GRK2 AND USES THEREOF CYGNAL THERAPEUTICS, INC. (US) 2022-07-28 WO disclosed