SCHEMBL8979392

SCHEMBL8979392

NC(=O)c1cc(Cl)c(CO)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ PARP1 P09874 4/20 0.41
▸ BCAT2 O15382 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.37
▸ CYP3A4 P08684 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TSHR P16473 3/20 0.36
▸ TTR P02766 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ POLB P06746 3/20 0.34
▸ STING1 Q86WV6 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ PMP22 Q01453 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL8979344 0.80 TTR (0.58) LMNAHTTKDM4ESMN1; SMN2TSHR
SCHEMBL10201339 0.78 CA5A (0.43) LMNAHTTKDM4ETSHRTTR
SCHEMBL3130004 0.77 LMNA (0.47) LMNAHTTPARP1BCAT2KDM4E
SCHEMBL30325618 0.75 HSD11B1 (0.50) LMNAHTTPARP1BCAT2KDM4E
SCHEMBL4104322 0.75 TTR (0.62) LMNAHTTPARP1BCAT2CYP3A4
SCHEMBL811037 0.75 LMNA (0.46) LMNAHTTPARP1BCAT2KDM4E
SCHEMBL18602709 0.74 PARP1 (0.45) LMNAHTTPARP1CYP3A4SMN1; SMN2
SCHEMBL1003805 0.73 LMNA (0.49) LMNAHTTPARP1BCAT2KDM4E
SCHEMBL27851699 0.73 LMNA (0.44) LMNAHTTPARP1BCAT2KDM4E
SCHEMBL27864269 0.73 HTT (0.44) LMNAHTTPARP1BCAT2KDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0604019-B1 N-Acetonylbenzamides and their use as fungicides ROHM & HAAS (US) 1996-05-08 — — EP disclosed
EP-0604019-A1 N-Acetonylbenzamides and their use as fungicides ROHM AND HAAS COMPANY (US) 1994-06-29 — — EP disclosed
US-5254584-A Controlling phytopathogens ROHM AND HAAS COMPANY (US) 1993-10-19 — — US disclosed
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