SCHEMBL24322875

SCHEMBL24322875

CNC12CC(C(=O)NCCOc3ccc(F)cc3)(C1)C2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ MAPT P10636 3/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ EPHX2 P34913 1/20 0.45
▸ FAAH O00519 1/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.43
▸ MTNR1A P48039 2/20 0.43
▸ MTNR1B P49286 2/20 0.43
▸ NPC1 O15118 2/20 0.42
▸ LTA4H P09960 1/20 0.42
▸ DRD2 P14416 1/20 0.42
▸ DRD4 P21917 1/20 0.42
▸ DRD3 P35462 1/20 0.42
▸ USP2 O75604 1/20 0.41

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
SCHEMBL19577395 0.79 ATF4 (0.62) LMNASMN1; SMN2KMT2AALDH1A1DRD2
SCHEMBL5113209 0.74 MTNR1A (0.73) LMNASMN1; SMN2MAPTKMT2AL3MBTL1
SCHEMBL3446997 0.73 SMN1; SMN2 (0.55) LMNASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL31483051 0.71 SMN1; SMN2 (0.53) LMNASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL19577397 0.70 ATF4 (0.62) LMNAMAPTKMT2AL3MBTL1ALDH1A1
SCHEMBL9634003 0.70 MTNR1A (0.53) LMNASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL22395386 0.69 ATF4 (0.61) —
SCHEMBL24324190 0.69 ATF4 (0.52) LMNASMN1; SMN2KMT2AALDH1A1NPC1
SCHEMBL9632340 0.69 LTA4H (0.55) LMNASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL3585001 0.69 CA12 (0.67) LMNASMN1; SMN2MAPTL3MBTL1RAB9A

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
EP-3452453-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2022-04-13 — — EP disclosed
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