SCHEMBL4886981

SCHEMBL4886981

Clc1cccc(Cl)c1.O=C1C=CC(=Nc2ccc(O)cc2)C=C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TXNRD1 Q16881 1/20 0.57
TXNRD3 Q86VQ6 1/20 0.57
TXNRD2 Q9NNW7 1/20 0.57
ESR1 P03372 3/20 0.43
ESR2 Q92731 3/20 0.43
TSHR P16473 1/20 0.40
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
MITF O75030 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
NFKB1 P19838 1/20 0.39
RAB9A P51151 1/20 0.39
PAX8 Q06710 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
2,6-Dichlorophenol SCHEMBL1030875 0.86 TXNRD1 (0.63) TXNRD1TXNRD3TXNRD2ESR1ESR2
SCHEMBL35153 0.85 TXNRD1 (0.58) TXNRD1TXNRD3TXNRD2ESR1ESR2
2,6-Dichlorophenol SCHEMBL5320190 0.84 TXNRD1 (0.61) TXNRD1TXNRD3TXNRD2ESR1ESR2
2,4-Dichlorophenol SCHEMBL1591732 0.84 TXNRD1 (0.56) TXNRD1TXNRD3TXNRD2ESR1ESR2
SCHEMBL21358790 0.83 TXNRD1 (0.58) TXNRD1TXNRD3TXNRD2ESR1ESR2
SCHEMBL11318738 0.83 TXNRD1 (0.56) TXNRD1TXNRD3TXNRD2ESR1ESR2
SCHEMBL21192750 0.83 TXNRD1 (0.56) TXNRD1TXNRD3TXNRD2ESR1ESR2
SCHEMBL901181 0.83 TXNRD1 (0.56) TXNRD1TXNRD3TXNRD2ESR1ESR2
Ammonia Solution, Strong SCHEMBL10606612 0.83 TXNRD1 (0.56) TXNRD1TXNRD3TXNRD2ESR1ESR2
Ammonia Solution, Strong SCHEMBL11281990 0.83 TXNRD1 (0.56) TXNRD1TXNRD3TXNRD2ESR1ESR2

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-20080138614-A1 Apparatus for indicating the passage of time, composition and forming method thereof SU, WEI-FANG (TW) 2008-06-12 US disclosed
CN-101196729-A Time history indicating device, formula and forming method thereof LIN WEIFANG LI QIRU (CN) 2008-06-11 CN disclosed