SCHEMBL30293178

SCHEMBL30293178

O=C1c2cccc(O)c2C(=O)c2c1ccc(CCl)c2O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 14/20 0.69
CTSG P08311 8/20 0.69
MAOA P21397 4/20 0.62
ALDH1A1 P00352 3/20 0.62
MAPT P10636 3/20 0.62
MAPK1 P28482 3/20 0.62
MAOB P27338 2/20 0.62
TSHR P16473 2/20 0.62
TDP1 Q9NUW8 2/20 0.62
HPGD P15428 2/20 0.62
ALOX15 P16050 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
HSD17B10 Q99714 2/20 0.62
LMNA P02545 1/20 0.62
HTT P42858 1/20 0.62
FTO Q9C0B1 1/20 0.57
AURKA O14965 1/20 0.51
AURKB Q96GD4 1/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50

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
SCHEMBL11297243 0.88 ELANE (0.51) ELANECTSGMAOAALDH1A1MAPT
SCHEMBL11302517 0.83 AURKA (0.54) ELANECTSGMAOAALDH1A1MAPT
SCHEMBL29109693 0.82 ELANE (0.68) ELANECTSGMAOAALDH1A1MAPT
SCHEMBL9539603 0.81 ELANE (0.74) ELANECTSGALDH1A1MAPTSMN1; SMN2
SCHEMBL11236785 0.81 ELANE (0.68) ELANECTSGMAOAALDH1A1MAPT
SCHEMBL29929513 0.80 MAOA (0.77) ELANECTSGMAOAALDH1A1MAPT
SCHEMBL6901176 0.80 MAOA (0.77) ELANECTSGMAOAALDH1A1MAPT
SCHEMBL8382640 0.80 ELANE (0.78) ELANECTSGMAOAALDH1A1MAPT
Danthron SCHEMBL30544826 0.79 MAPT (1.00) ELANECTSGMAOAALDH1A1MAPT
Danthron SCHEMBL29356886 0.79 MAPT (1.00) ELANECTSGMAOAALDH1A1MAPT

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
CN-112920141-B Rhein derivatives and antiviral application thereof 中检科医药科技(北京)集团有限公司 2023-03-17 CN disclosed