SCHEMBL31662878

SCHEMBL31662878

Cc1cc(N2CCN(C(=O)OC(C)(C)C)CC2)ccc1CN1C(=O)C(Cl)=C(Cl)C1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
HTT P42858 2/20 0.42
PDK2 Q15119 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
GPR119 Q8TDV5 3/20 0.42
MAPT P10636 3/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
P2RX7 Q99572 2/20 0.42
MAPK1 P28482 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CYP2C19 P33261 1/20 0.41
TSHR P16473 1/20 0.40
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
SUV39H2 Q9H5I1 3/20 0.40
VEGFA P15692 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
ALK Q9UM73 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
SCHEMBL31662897 0.88 ALDH1A1 (0.42) HTTNPSR1ALDH1A1LMNAMEN1
SCHEMBL31662801 0.86 SMN1; SMN2 (0.53) SMN1; SMN2HTTNPSR1GPR119MAPT
SCHEMBL31663188 0.85 MMP13 (0.34) SMN1; SMN2HTTPDK2NPSR1MAPT
SCHEMBL31662949 0.82 CCR1 (0.39) SMN1; SMN2HTTMAPTALDH1A1LMNA
SCHEMBL31662904 0.81 MAPT (0.35) SMN1; SMN2HTTPDK2NPSR1MAPT
SCHEMBL31663164 0.80 ADRB1 (0.45) HTTALDH1A1LMNAP2RX7CYP2C19
SCHEMBL31662870 0.79 P2RX7 (0.41) SMN1; SMN2HTTNPSR1MAPTLMNA
SCHEMBL31662798 0.79 KHK (0.42) HTTMAPTALDH1A1CYP2C19TSHR
SCHEMBL31662829 0.78 VEGFA (0.41) SMN1; SMN2HTTNPSR1GPR119MAPT
SCHEMBL31662794 0.77 MAPT (0.53) SMN1; SMN2HTTPDK2NPSR1GPR119

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-2025147756-A1 VIRAL SENSITIZERS COMPOSITIONS, METHODS AND USES THEREOF OTTAWA HOSPITAL RESEARCH INSTITUTE (CA) 2025-07-17 WO disclosed