SCHEMBL27429367

SCHEMBL27429367

Oc1ccc(Cl)c(Oc2ccccc2)c1Oc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 5/20 0.49
LTA4H P09960 2/20 0.43
NR1H2 P55055 1/20 0.43
BAX Q07812 1/20 0.43
TSHR P16473 1/20 0.42
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
THRA P10827 2/20 0.38
THRB P10828 2/20 0.38
STK39 Q9UEW8 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
ESR2 Q92731 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
ALDH1A1 P00352 1/20 0.38
NPBWR1 P48145 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
SCHEMBL663380 0.88 CYP3A4 (0.46) RHEBLTA4HNR1H2BAXTSHR
SCHEMBL10931576 0.87 LTA4H (0.55) LTA4HNR1H2BAXTSHRMAPT
SCHEMBL1532087 0.84 ALDH1A1 (0.48) RHEBLTA4HNR1H2BAXTSHR
SCHEMBL10412578 0.83 LTA4H (0.46) RHEBLTA4HNR1H2BAXTSHR
SCHEMBL982234 0.78 TTR (0.50) LTA4HNR1H2BAXTSHRMAPT
SCHEMBL2714039 0.77 LTA4H (0.48) LTA4HNR1H2BAXTSHRMAPT
SCHEMBL11432939 0.77 RHEB (0.53) RHEBLTA4HNR1H2BAXTSHR
SCHEMBL1834612 0.76 LTA4H (0.52) LTA4HNR1H2BAXTSHRMAPT
SCHEMBL9645022 0.76 LTA4H (0.52) RHEBLTA4HNR1H2BAXTSHR
Diphenylether SCHEMBL27653681 0.76 CYP3A4 (0.64) RHEBLTA4HNR1H2BAXTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106924079-A Sterilizing anhydrous cleaning agent 南通蛇类治疗研究所 2017-07-07 CN disclosed
CN-104606119-A Sterilizing and disinfecting waterless hand cleaner NANTONG SNAKE TREAT RES INST 2015-05-13 CN disclosed
CN-1114876-A Use of a spin trap in a cosmetic or dermatological composition OREAL (FR) 1996-01-17 CN disclosed