SCHEMBL8877720

SCHEMBL8877720

Cc1c(C)c(C2CC(=O)C=C(O)C2)c(C)c2c1CC(C)(C)O2

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.40
MAPT P10636 3/20 0.40
APOBEC3A P31941 1/20 0.40
RECQL P46063 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.36
ALOX12 P18054 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TSHR P16473 1/20 0.35
GAA P10253 1/20 0.35
EZH2 Q15910 1/20 0.30

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
SCHEMBL8877135 0.89 POLB (0.39) POLBMAPTAPOBEC3ARECQLAPOBEC3G
SCHEMBL10679929 0.78 POLB (0.50) POLBMAPTAPOBEC3ARECQLAPOBEC3G
SCHEMBL10791397 0.77 POLB (0.42) POLBMAPTAPOBEC3ARECQLAPOBEC3G
SCHEMBL8876820 0.73 POLB (0.31) POLBMAPTTDP1
SCHEMBL8878032 0.72 RAB9A (0.32)
SCHEMBL10794184 0.72 POLB (0.42) POLBMAPTAPOBEC3ARECQLAPOBEC3G
SCHEMBL10790749 0.72 POLB (0.42) POLBMAPTAPOBEC3ARECQLAPOBEC3G
SCHEMBL8637703 0.70 POLB (0.31) POLBMAPTTDP1
SCHEMBL9722642 0.70 POLB (0.41) POLBMAPTAPOBEC3ARECQLAPOBEC3G
SCHEMBL10792670 0.69 POLB (0.42) POLBMAPTAPOBEC3ARECQLAPOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5631208-A Herbicidal cyclohexane-1,3-dione derivatives and their preparation process KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1997-05-20 US disclosed
WO-1994003443-A1 HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES AND THEIR PREPARATION PROCESS KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1994-02-17 WO disclosed