SCHEMBL8840346

SCHEMBL8840346

O=C(O)c1cc(Cl)c(I)c(Cl)c1.[N-]=[N+]=N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 2/20 0.52
▸ TPMT P51580 5/20 0.48
▸ TSHR P16473 3/20 0.45
▸ SRD5A2 P31213 1/20 0.40
▸ PLAU P00749 1/20 0.40
▸ HCAR1 Q9BXC0 1/20 0.39
▸ CA12 O43570 2/20 0.37
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ CA7 P43166 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ CA14 Q9ULX7 2/20 0.37
▸ ALOX15 P16050 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ CA3 P07451 1/20 0.35
▸ SELL P14151 1/20 0.35

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
SCHEMBL670788 0.87 TTR (0.65) TTRTPMTTSHRSRD5A2PLAU
SCHEMBL8840252 0.86 TTR (0.54) TTRTPMTTSHRSRD5A2PLAU
SCHEMBL8840331 0.82 TTR (0.50) TTRTPMTTSHRSRD5A2PLAU
SCHEMBL8840267 0.82 TTR (0.50) TTRTPMTTSHRSRD5A2PLAU
SCHEMBL26095257 0.78 TTR (0.59) TTRTPMTTSHRSRD5A2PLAU
SCHEMBL30413369 0.78 TTR (0.59) TTRTPMTTSHRSRD5A2PLAU
SCHEMBL23699468 0.76 TTR (0.52) TTRTPMTTSHRSRD5A2PLAU
2,6-Dichloroisonicotinic Acid SCHEMBL11350560 0.76 TPMT (0.45) TTRTPMTTSHRHCAR1CA12
Terephthalic Acid SCHEMBL7587474 0.71 TSHR (0.67) TPMTTSHRSRD5A2CA12CA1
SCHEMBL7263572 0.71 TTR (0.68) TTRTPMTTSHRSRD5A2PLAU

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-5607977-A PESTICIDES SHELL AGRAR GMBH & CO. KG (DE) 1997-03-04 — — US disclosed
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