SCHEMBL24740428

SCHEMBL24740428

CCOC(=O)CCCCC1CCCC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.55
USP2 O75604 1/20 0.55
ALDH1A1 P00352 1/20 0.55
ALOX15 P16050 1/20 0.55
CYP1A2 P05177 2/20 0.48
KDM5A P29375 3/20 0.46
PHF8 Q9UPP1 3/20 0.46
KDM2A Q9Y2K7 3/20 0.46
KDM4C Q9H3R0 2/20 0.46
KDM4A O75164 1/20 0.45
NAAA Q02083 2/20 0.45
SMYD3 Q9H7B4 1/20 0.44
EPHX1 P07099 1/20 0.44
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL11021041 0.98 USP2 (0.54) TDP1USP2ALDH1A1ALOX15CYP1A2
SCHEMBL28992177 0.98 USP2 (0.54) TDP1USP2ALDH1A1ALOX15CYP1A2
SCHEMBL16059433 0.97 USP2 (0.56) TDP1USP2ALDH1A1ALOX15CYP1A2
SCHEMBL16060975 0.97 USP2 (0.56) TDP1USP2ALDH1A1ALOX15CYP1A2
SCHEMBL5827221 0.93 CYP1A2 (0.48) TDP1USP2ALDH1A1ALOX15CYP1A2
SCHEMBL7683870 0.93 CYP1A2 (0.48) TDP1USP2ALDH1A1ALOX15CYP1A2
Methylamine SCHEMBL27773382 0.91 CYP1A2 (0.52) TDP1USP2ALDH1A1ALOX15CYP1A2
SCHEMBL15369772 0.91 CYP1A2 (0.50) TDP1USP2ALDH1A1ALOX15CYP1A2
SCHEMBL4449957 0.91 ALDH1A1 (0.60) TDP1USP2ALDH1A1ALOX15CYP1A2
SCHEMBL16670930 0.91 ALDH1A1 (0.60) TDP1USP2ALDH1A1ALOX15CYP1A2

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-2022253101-A1 PYRIDAZINONE COMPOUND AS PARP7 INHIBITOR 上海优理惠生医药有限公司 2022-12-08 WO disclosed