SCHEMBL8385016

SCHEMBL8385016

CCC(=O)Oc1cccc(OCCC(c2ccccc2)(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.48
▸ LMNA P02545 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ ELANE P08246 1/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ GAA P10253 1/20 0.42
▸ ESR1 P03372 2/20 0.41
▸ FAAH O00519 1/20 0.41
▸ BCL2 P10415 1/20 0.40

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
SCHEMBL8381125 0.90 KMT2A (0.44) LMNAMAPK1L3MBTL1KDM4EALDH1A1
SCHEMBL8385080 0.88 ELANE (0.54) LMNAELANEKDM4EALDH1A1SMN1; SMN2
SCHEMBL8383452 0.86 LMNA (0.46) ACHELMNAMAPK1L3MBTL1KDM4E
SCHEMBL8385089 0.82 KMT2A (0.50) LMNAKDM4EALDH1A1KMT2AGAA
SCHEMBL8383409 0.81 LMNA (0.56) LMNAMAPK1KDM4EALDH1A1SMN1; SMN2
SCHEMBL27762476 0.80 KMT2A (0.59) ACHELMNAMAPK1L3MBTL1ELANE
SCHEMBL8381123 0.80 CYSLTR2 (0.52) —
SCHEMBL8383401 0.80 KIF11 (0.41) LMNAL3MBTL1ELANEKDM4EALDH1A1
SCHEMBL8381127 0.80 PPARG (0.48) LMNAMAPK1L3MBTL1SMN1; SMN2KMT2A
SCHEMBL28584198 0.79 ACHE (0.56) ACHEKMT2AFAAH

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-5874436-A EFFECTIVE IN INHIBITING THE ACTION OF A BACTERIAL HISTIDINE PROTEIN KINASE; USEFUL AGAINST ANTIBIOTIC RESISTANT ORGANISMS DEMERS JAMES P (US) 1999-02-23 — — US disclosed
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