SCHEMBL24920545

SCHEMBL24920545

CN1CCc2cnc(N3CCNCC3)nc2C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 5/20 0.43
CYP1A2 P05177 4/20 0.43
HPGD P15428 4/20 0.43
HSD17B10 Q99714 4/20 0.43
CASP1 P29466 3/20 0.43
CASP7 P55210 3/20 0.43
CYP2C19 P33261 3/20 0.43
CYP3A4 P08684 2/20 0.43
TSHR P16473 1/20 0.43
LMNA P02545 3/20 0.42
MAPT P10636 3/20 0.41
TP53 P04637 2/20 0.40
CYP2C9 P11712 2/20 0.39
HIF1A Q16665 2/20 0.39
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
HSP90AB1 P08238 1/20 0.39
CETP P11597 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
SCHEMBL24920554 0.89 LMNA (0.50) POLBSMN1; SMN2ALDH1A1CYP1A2HPGD
SCHEMBL24921798 0.83 HSP90AB1 (0.47) POLBALDH1A1CYP1A2HSD17B10TSHR
SCHEMBL8808226 0.79 ALDH1A1 (0.45) POLBSMN1; SMN2ALDH1A1CYP1A2HPGD
SCHEMBL25677916 0.79 HTR2C (0.56) POLBSMN1; SMN2ALDH1A1CYP1A2HPGD
SCHEMBL8898686 0.79 SMN1; SMN2 (0.54) POLBSMN1; SMN2ALDH1A1CYP1A2HPGD
SCHEMBL24920524 0.79 LMNA (0.39) POLBSMN1; SMN2ALDH1A1CYP1A2HPGD
SCHEMBL24921047 0.78 ALDH1A1 (0.44) POLBSMN1; SMN2ALDH1A1CYP1A2HPGD
Hydrochloric Acid SCHEMBL8898072 0.78 SMN1; SMN2 (0.52) POLBSMN1; SMN2ALDH1A1CYP1A2HPGD
SCHEMBL24920528 0.76 LMNA (0.61) POLBLMNAMAPTTP53HSP90AB1
SCHEMBL24920575 0.76 LMNA (0.39) POLBLMNAMAPTTP53HSP90AB1

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-2023006097-A1 BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER 海创药业股份有限公司 2023-02-02 WO disclosed