SCHEMBL2803235

SCHEMBL2803235

CCOCC1=CC([Zr](Cl)(Cl)C2C=C(COCC)c3ccccc32)c2ccccc21

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL6062011 0.75 HTR6 (0.35)
Hydrochloric Acid SCHEMBL2803234 0.75 BCHE (0.32) NPC1TP53TSHRRAB9ASMN1; SMN2
SCHEMBL23528115 0.75 HTR6 (0.35)
SCHEMBL2805344 0.74 HTR6 (0.33)
SCHEMBL7085408 0.71 GPR3 (0.33)
SCHEMBL6062222 0.71 KDM4E (0.31) TP53SMN1; SMN2
SCHEMBL20996660 0.67 MEN1 (0.34)
SCHEMBL8857693 0.67 GPR3 (0.31)
SCHEMBL3684603 0.65
Ether SCHEMBL6746857 0.63 HTR2A (0.45) NPC1TP53TSHRRAB9ASMN1; SMN2

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-2253648-A1 POLYOLEFIN GRAFT COPOLYMER AND ADHESIVE COMPOSITION Idemitsu Kosan Co., Ltd. (JP) 2010-11-24 EP disclosed