SCHEMBL9816151

SCHEMBL9816151

ClC(Cl)(Cl)c1ccc(C(Cl)(Cl)Cl)cc1.ClC(Cl)(Cl)c1ccc(C(Cl)(Cl)Cl)cc1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.67
MAPK1 P28482 2/20 0.38
HIF1A Q16665 1/20 0.38
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.31
CYP19A1 P11511 1/20 0.31
CYP3A4 P08684 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
CYP1A2 P05177 1/20 0.30

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
SCHEMBL545084 1.00 TSHR (0.67) TSHRMAPK1HIF1AMEN1KMT2A
SCHEMBL1538637 0.89 TSHR (0.56) TSHRMAPK1HIF1ACYP3A4TDP1
SCHEMBL7949296 0.89 TSHR (0.56) TSHRMAPK1HIF1A
SCHEMBL196830 0.86 TSHR (0.57) TSHRMAPK1HIF1AMEN1KMT2A
SCHEMBL11231213 0.86 TSHR (0.53) TSHRMAPK1HIF1A
SCHEMBL526434 0.83 ESR1 (0.52) TSHRHIF1AMEN1KMT2ALMNA
SCHEMBL1538589 0.83 TSHR (0.55) TSHRLMNACYP19A1TDP1
SCHEMBL3869048 0.83 TSHR (0.50) TSHRMAPK1HIF1AMEN1KMT2A
SCHEMBL11209484 0.83 TSHR (0.55) TSHRMAPK1LMNATDP1
SCHEMBL11254085 0.83 TSHR (0.50) TSHRMAPK1HIF1A

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
EP-0449811-A1 IMPROVED PROCESS FOR SYNTHESIS OF HETEROCYCLIC POLYMERS THE DOW CHEMICAL COMPANY (US) 1991-10-09 EP disclosed