SCHEMBL21894077

SCHEMBL21894077

CCN(CC)C(=O)CCSC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.58
ALDH1A1 P00352 6/20 0.48
HPGD P15428 3/20 0.48
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP8 P22894 1/20 0.39
GBA1 P04062 2/20 0.36
ALDH2 P05091 2/20 0.35
PHGDH O43175 2/20 0.34
MGLL Q99685 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
HSD17B10 Q99714 3/20 0.34
TSHR P16473 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PLIN1 O60240 1/20 0.32
GMNN O75496 1/20 0.32

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
SCHEMBL24225014 0.82 ALDH1A1 (0.50) LMNAALDH1A1HPGDMMP1MMP2
SCHEMBL15948654 0.79 ALDH1A1 (0.57) LMNAALDH1A1HPGDMMP1MMP2
SCHEMBL2327551 0.79 LMNA (0.78) LMNAALDH1A1HPGDMMP1MMP2
SCHEMBL20220309 0.77 LMNA (0.60) LMNAALDH1A1HPGDMMP1MMP2
SCHEMBL3897633 0.75 LMNA (0.64) LMNAALDH1A1HPGDMMP1MMP2
SCHEMBL13461838 0.75 LMNA (0.50) LMNAALDH1A1HPGDMMP1MMP2
SCHEMBL7134945 0.75
SCHEMBL18735214 0.74 LMNA (0.50) LMNAALDH1A1HPGDMMP1MMP2
SCHEMBL3306771 0.74 LMNA (0.89) LMNAALDH1A1HPGDMMP1MMP2
SCHEMBL633287 0.74 LMNA (0.70) LMNAALDH1A1HPGDMMP1MMP2

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
EP-3943087-A1 HETEROARYL COMPOUNDS AND USES THEREOF Celgene CAR LLC (BM) 2022-01-26 EP disclosed
EP-2953457-B1 ERK INHIBITORS AND USES THEREOF CELGENE CAR LLC (BM) 2020-04-08 EP disclosed