SCHEMBL8942339

SCHEMBL8942339

[O]c1ccc(Oc2ccccc2)c(Oc2ccccc2)c1Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
LTA4H P09960 1/20 0.44
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
TTR P02766 4/20 0.41
CTNNB1 P35222 1/20 0.40
KDM4E B2RXH2 2/20 0.39
GLA P06280 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ADORA2A P29274 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37

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
SCHEMBL19205830 0.84 LTA4H (0.55) TSHRLTA4HKMT2ALMNAGAA
SCHEMBL2091702 0.83 KMT2A (0.47) TSHRLTA4HKMT2ALMNAGAA
SCHEMBL28622860 0.78 LTA4H (0.42) TSHRLTA4HKMT2ALMNAGAA
SCHEMBL982234 0.75 TTR (0.50) TSHRLTA4HKMT2ATTRCTNNB1
SCHEMBL28952509 0.75 LTA4H (0.44) TSHRLTA4HKMT2ALMNAGAA
SCHEMBL5034123 0.75 LTA4H (0.44) TSHRLTA4HKMT2ALMNAGAA
SCHEMBL10766141 0.75 CYP1A2 (0.52) TSHRLTA4HKMT2ALMNAGAA
SCHEMBL9780873 0.75 LTA4H (0.55) TSHRLTA4HKMT2ALMNAGAA
SCHEMBL6003156 0.75 CAMK2A (0.41) TSHRLTA4HKMT2ALMNAGAA
SCHEMBL9273369 0.73 TSHR (0.52) TSHRLTA4HKMT2ALMNAGAA

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
US-5557003-A SOLVENT EXTRACTION OF ZINC FROM ORE ZENECA LIMITED (GB) 1996-09-17 US disclosed