SCHEMBL24372374

SCHEMBL24372374

O=C(N1CCCCC1)C1(c2ccc(CNCCO)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 12/20 0.57
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
GRIA2 P42262 1/20 0.42
DPP7 Q9UHL4 1/20 0.40

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
SCHEMBL24372381 0.99 HSD11B1 (0.56) HSD11B1MEN1KMT2AALDH1A1LMNA
SCHEMBL24372411 0.85 HSD11B1 (0.54) HSD11B1MEN1KMT2AALDH1A1LMNA
SCHEMBL31042808 0.84 HSD11B1 (0.53) HSD11B1MEN1KMT2AALDH1A1LMNA
SCHEMBL24372403 0.84 HSD11B1 (0.53) HSD11B1MEN1KMT2AALDH1A1LMNA
SCHEMBL24372378 0.82 HSD11B1 (0.57) HSD11B1MEN1KMT2AALDH1A1LMNA
SCHEMBL24372421 0.81 HSD11B1 (0.56) HSD11B1MEN1KMT2AALDH1A1LMNA
SCHEMBL5643459 0.73 HSD11B1 (0.71) HSD11B1MEN1KMT2AALDH1A1LMNA
SCHEMBL24372566 0.72 ALDH1A1 (0.39) KMT2AALDH1A1TSHRSMN1; SMN2DPP7
SCHEMBL348724 0.71 HSD11B1 (1.00) HSD11B1MEN1KMT2AALDH1A1
SCHEMBL3139523 0.71 HSD11B1 (0.71) HSD11B1MEN1KMT2AALDH1A1LMNA

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