SCHEMBL23752256

SCHEMBL23752256

CCCC[C@@H](CC)CS(=O)(=O)O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
CA2 P00918 6/20 0.47
TDP1 Q9NUW8 2/20 0.46
RECQL P46063 1/20 0.46
CYP3A4 P08684 5/20 0.45
TSHR P16473 4/20 0.45
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
TP53 P04637 1/20 0.41
MAPK1 P28482 1/20 0.39
CA1 P00915 1/20 0.38
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL438255 1.00 ALDH1A1 (0.52) ALDH1A1CA2TDP1RECQLCYP3A4
Calcium SCHEMBL1526989 0.98 ALDH1A1 (0.50) ALDH1A1CA2TDP1RECQLCYP3A4
SCHEMBL125029 0.98 ALDH1A1 (0.50) ALDH1A1CA2TDP1RECQLCYP3A4
Ammonia Solution, Strong SCHEMBL28809344 0.98 ALDH1A1 (0.50) ALDH1A1CA2TDP1RECQLCYP3A4
Fluoride SCHEMBL28530943 0.98 ALDH1A1 (0.50) ALDH1A1CA2TDP1RECQLCYP3A4
SCHEMBL3468193 0.98 ALDH1A1 (0.50) ALDH1A1CA2TDP1RECQLCYP3A4
Fluoride SCHEMBL4338249 0.96 ALDH1A1 (0.48) ALDH1A1CA2TDP1RECQLCYP3A4
SCHEMBL8810590 0.94 TP53 (0.48) ALDH1A1CA2TDP1RECQLCYP3A4
SCHEMBL8437242 0.92 LMNA (0.48) ALDH1A1CA2TDP1RECQLCYP3A4
SCHEMBL3460439 0.92 LMNA (0.48) ALDH1A1CA2TDP1RECQLCYP3A4

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
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed
US-20210254056-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION 2021-08-19 US disclosed