SCHEMBL24372369

SCHEMBL24372369

O=C(CO)NCc1cccc(C2(C(=O)N3CCCCC3)CC2)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 9/20 0.54
KMT2A Q03164 3/20 0.50
MEN1 O00255 1/20 0.50
LMNA P02545 2/20 0.46
TSHR P16473 2/20 0.46
ALDH1A1 P00352 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ERCC1 P07992 1/20 0.42
ERCC4 Q92889 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL24372376 0.99 HSD11B1 (0.53) HSD11B1KMT2AMEN1LMNATSHR
SCHEMBL24372378 0.85 HSD11B1 (0.57) HSD11B1KMT2AMEN1LMNATSHR
SCHEMBL24372370 0.84 HSD11B1 (0.58) HSD11B1KMT2AMEN1LMNATSHR
SCHEMBL24372421 0.84 HSD11B1 (0.56) HSD11B1KMT2AMEN1LMNATSHR
SCHEMBL24372411 0.84 HSD11B1 (0.54) HSD11B1KMT2AMEN1LMNATSHR
SCHEMBL24372437 0.83 HSD11B1 (0.57) HSD11B1KMT2AMEN1LMNATSHR
SCHEMBL31042808 0.82 HSD11B1 (0.53) HSD11B1KMT2AMEN1LMNATSHR
SCHEMBL24372403 0.82 HSD11B1 (0.53) HSD11B1KMT2AMEN1LMNATSHR
SCHEMBL5094217 0.79 HSD11B1 (0.61) HSD11B1KMT2AMEN1LMNATSHR
Hydrochloric Acid SCHEMBL5098968 0.77 F10 (0.45) HSD11B1

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-3988090-A1 P62 LIGAND COMPOUND AND ER-PHAGY-PROMOTING USE THEREOF Protech Inc. (KR) 2022-04-27 EP disclosed