SCHEMBL25501601

SCHEMBL25501601

O=C(O)C1CCN(C(=O)C2CCCCC2)C1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.63
TSHR P16473 1/20 0.63
HSD11B1 P28845 10/20 0.57
SMN1; SMN2 Q16637 1/20 0.56
HSD11B2 P80365 3/20 0.53
HPGD P15428 1/20 0.52
LMNA P02545 1/20 0.49
CHRNB2 P17787 1/20 0.48
CHRNA3 P32297 1/20 0.48
CHRNA4 P43681 1/20 0.48
CHRNB3 Q05901 1/20 0.48
CHRNA6 Q15825 1/20 0.48
PTPN1 P18031 1/20 0.46

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
SCHEMBL27024183 1.00 ALDH1A1 (0.63) ALDH1A1TSHRHSD11B1SMN1; SMN2HSD11B2
SCHEMBL20827024 0.92 ALDH1A1 (0.63) ALDH1A1TSHRHSD11B1SMN1; SMN2HSD11B2
SCHEMBL3283711 0.92 HPGD (0.56) ALDH1A1TSHRHSD11B1SMN1; SMN2HSD11B2
SCHEMBL4156159 0.90 ALDH1A1 (0.72) ALDH1A1TSHRHSD11B1SMN1; SMN2HSD11B2
SCHEMBL4150572 0.88 ALDH1A1 (0.68) ALDH1A1TSHRHSD11B1SMN1; SMN2HSD11B2
SCHEMBL4696770 0.85 HSD11B1 (0.69) ALDH1A1TSHRHSD11B1SMN1; SMN2HSD11B2
SCHEMBL1344660 0.83 ALDH1A1 (0.61) ALDH1A1TSHRHSD11B1SMN1; SMN2HPGD
SCHEMBL3720831 0.80 MAPT (0.55) ALDH1A1TSHRHSD11B1HSD11B2HPGD
SCHEMBL2875954 0.79 NOTUM (0.46) ALDH1A1LMNA
SCHEMBL652433 0.79 NOTUM (0.46) ALDH1A1LMNA

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-2023086399-A1 BIFUNCTIONAL DEGRADERS OF HEMATOPOIETIC PROGENITOR KINASE AND THERAPEUTIC USES THEREOF NURIX THERAPEUTICS, INC. (US) 2023-05-19 WO disclosed