SCHEMBL8019351

SCHEMBL8019351

Cc1cc(O)ccc1C(=O)CCC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.64
KMT2A Q03164 5/20 0.57
MEN1 O00255 2/20 0.57
HSP90AB1 P08238 1/20 0.44
CYP1A1 P04798 1/20 0.43
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 2/20 0.42
TSHR P16473 2/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
P4HB P07237 1/20 0.42
MAPK1 P28482 1/20 0.42
PAX8 Q06710 1/20 0.42
USP5 P45974 1/20 0.42
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
GLA P06280 1/20 0.41
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL31661658 0.84 KMT2A (0.74) HTTKMT2AMEN1TSHRTP53
SCHEMBL3519350 0.84 KMT2A (0.74) HTTKMT2AMEN1TSHRTP53
SCHEMBL27502289 0.82 HTT (0.46) HTTKMT2AMEN1HSP90AB1ALDH1A1
SCHEMBL1134290 0.81 HTT (0.62) HTTKMT2AMEN1HSP90AB1ALDH1A1
SCHEMBL8688272 0.81 HTT (0.62) HTTKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL4091424 0.81 HTT (0.62) HTTKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL3863307 0.81 HTT (0.62) HTTKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL1375365 0.80 CA12 (0.51) HTTKMT2AMEN1HSP90AB1ALDH1A1
SCHEMBL27735150 0.79 HSP90AB1 (0.53) HTTKMT2AMEN1HSP90AB1ALDH1A1
SCHEMBL7253586 0.79 HSP90AB1 (0.69) HTTKMT2AMEN1HSP90AB1ALDH1A1

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-2000024251-A1 COMPOSITION AND METHOD FOR COMBATTING PLANT FUNGI, AND PLANT FUNGUS INHIBITING COMPOUNDS GREEN CARE LABORATORIES LTD. (IL) 2000-05-04 WO disclosed