SCHEMBL11226539

SCHEMBL11226539

Nc1cc(C(=O)O)cc(C(Cl)Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ DDO Q99489 1/20 0.42
▸ TPMT P51580 3/20 0.40
▸ TTR P02766 2/20 0.38
▸ 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
▸ ANPEP P15144 2/20 0.36
▸ ENPEP Q07075 1/20 0.36
▸ TDP1 Q9NUW8 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ CA3 P07451 1/20 0.35
▸ MAPT P10636 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
SCHEMBL27891000 0.85 TPMT (0.48) KDM4EALDH1A1LMNATPMTTTR
SCHEMBL2727093 0.80 FABP3 (0.47) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL2820215 0.78 KDM4E (0.56) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL109155 0.78 KDM4E (0.56) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL223304 0.78 KDM4E (0.56) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL2724083 0.77 TPMT (0.42) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL28302239 0.77 TPMT (0.42) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL1477467 0.75 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
Water SCHEMBL17938300 0.75 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL2810739 0.75 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A

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-4344857-A Encapsulation by entrapment THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1982-08-17 — — US claimed
US-4344857-A Encapsulation by entrapment THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1982-08-17 — — US disclosed
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