SCHEMBL29330934

SCHEMBL29330934

CNCCCC[C@H](NC=O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CPB2 Q96IY4 1/20 0.39
▸ FOLH1 Q04609 12/20 0.39
▸ KISS1R Q969F8 1/20 0.35
▸ ADH1B P00325 1/20 0.34
▸ ADH1C P00326 1/20 0.34
▸ ADH1A P07327 1/20 0.34
▸ ADH4 P08319 1/20 0.34
▸ ADH7 P40394 1/20 0.34
▸ NOD1 Q9Y239 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ KDM4A O75164 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33

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
SCHEMBL16020193 0.86 CPB2 (0.38) CPB2FOLH1KISS1RNOD1SMN1; SMN2
SCHEMBL22020398 0.84 KISS1R (0.34) CPB2KISS1RADH1BADH1CADH1A
SCHEMBL14947854 0.84 KISS1R (0.38) CPB2KISS1RADH1BADH1CADH1A
SCHEMBL13057114 0.81 CPB2 (0.43) CPB2FOLH1KISS1RNOD1SMN1; SMN2
SCHEMBL434550 0.81 CPB2 (0.43) CPB2FOLH1KISS1RNOD1SMN1; SMN2
SCHEMBL19401625 0.81 CPB2 (0.43) CPB2FOLH1KISS1RNOD1SMN1; SMN2
SCHEMBL25548901 0.80 MEN1 (0.53) FOLH1NOD1
SCHEMBL28318789 0.80 ADH1B (0.56) ADH1BADH1CADH1AADH4ADH7
SCHEMBL20366018 0.80 ADH1B (0.56) ADH1BADH1CADH1AADH4ADH7
SCHEMBL8628188 0.79 ADH1B (0.46) ADH1BADH1CADH1AADH4ADH7

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-2024150132-A1 LIGAND-DRUG CONJUGATES SUN PHARMA ADVANCED RESEARCH COMPANY LIMITED (IN) 2024-07-18 — — WO disclosed
Send feedback