SCHEMBL25129248

SCHEMBL25129248

C/N=C(\N1CCCC1)N1CCN(C)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTT P42858 1/20 0.38
MGLL Q99685 2/20 0.38
PHGDH O43175 1/20 0.38
LMNA P02545 1/20 0.37
ALDH1A1 P00352 2/20 0.33
HTR1A P08908 1/20 0.33
KMT2A Q03164 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.32

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
SCHEMBL24052119 1.00 CYP1A2 (0.41) CYP1A2TDP1HTTMGLLPHGDH
SCHEMBL25698566 1.00 CYP1A2 (0.41) CYP1A2TDP1HTTMGLLPHGDH
SCHEMBL24051546 0.93 CYP1A2 (0.46) CYP1A2TDP1HTTMGLLPHGDH
SCHEMBL24052000 0.87 ALDH1A1 (0.36) CYP1A2MGLLPHGDHLMNAALDH1A1
SCHEMBL24052088 0.85 ALDH1A1 (0.39) CYP1A2TDP1MGLLPHGDHLMNA
SCHEMBL24052077 0.82 ALDH1A1 (0.33) CYP1A2ALDH1A1HPGD
SCHEMBL24052083 0.82
SCHEMBL24052006 0.80 SMN1; SMN2 (0.39) CYP1A2TDP1HTTMGLLPHGDH
SCHEMBL25751654 0.76 CYP1A2 (0.37) CYP1A2TDP1HTTMGLLPHGDH
SCHEMBL25766841 0.76 CYP1A2 (0.37) CYP1A2TDP1HTTMGLLPHGDH

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023220440-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-11-16 WO disclosed
WO-2023091644-A2 HSD17B13-RELATED DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2023-05-25 WO disclosed
WO-2023049218-A1 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2023-03-30 WO disclosed
WO-2022099159-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2022-05-12 WO disclosed
WO-2021234459-A2 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2021-11-25 WO disclosed
WO-2021237223-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2021-11-25 WO disclosed