SCHEMBL31522166

SCHEMBL31522166

COc1cc(C)cc(Oc2ccccc2NC(=O)[C@@H](C)N)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ MTNR1B P49286 1/20 0.48
▸ XIAP P98170 1/20 0.47
▸ CARM1 Q86X55 3/20 0.46
▸ PRMT6 Q96LA8 3/20 0.46
▸ POLB P06746 1/20 0.44
▸ LPAR1 Q92633 4/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ MAPT P10636 4/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43

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
SCHEMBL31522153 0.81 ADRA2C (0.65) LMNAL3MBTL1MTNR1BPOLBALDH1A1
SCHEMBL31522156 0.80 LMNA (0.43) LMNAL3MBTL1MTNR1BPOLBLPAR1
Hydrochloric Acid SCHEMBL8974944 0.79 ALDH1A1 (0.60) L3MBTL1POLBLPAR1ALDH1A1KMT2A
SCHEMBL8145865 0.77 MTNR1B (0.65) LMNAL3MBTL1MTNR1BPOLBLPAR1
SCHEMBL31522181 0.76 ADRA2C (0.72) LMNAL3MBTL1MTNR1BPOLBALDH1A1
SCHEMBL25386654 0.75 MTNR1B (0.59) LMNAL3MBTL1MTNR1BPOLBLPAR1
SCHEMBL25386658 0.75 MTNR1B (0.59) LMNAL3MBTL1MTNR1BPOLBLPAR1
SCHEMBL31522174 0.73 ADRA2C (0.72) L3MBTL1MTNR1BPOLBALDH1A1KMT2A
SCHEMBL31522180 0.72 MTNR1B (0.50) LMNAL3MBTL1MTNR1BPOLBALDH1A1
SCHEMBL11644195 0.72 XIAP (0.48) LMNAMTNR1BXIAPCARM1PRMT6

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-2025054318-A1 PCNA INHIBITORS AND USES THEREOF CITY OF HOPE (US) 2025-03-13 — — WO disclosed
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