SCHEMBL7959265

SCHEMBL7959265

O=C(O)C(O)(CO/N=C/c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.48
▸ PLA2G7 Q13093 2/20 0.45
▸ LMNA P02545 3/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ PPARG P37231 3/20 0.39
▸ PPARA Q07869 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ S1PR4 O95977 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ S1PR1 P21453 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ MIF P14174 1/20 0.38
▸ UNG P13051 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37

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
SCHEMBL8420258 1.00 ATM (0.48) ATMPLA2G7LMNANPC1RAB9A
SCHEMBL23302281 0.73 NPC1 (0.45) ATMPLA2G7LMNANPC1RAB9A
SCHEMBL8613027 0.73 ATM (0.59) ATMPLA2G7LMNANPC1RAB9A
SCHEMBL8291064 0.73 ATM (0.59) ATMPLA2G7LMNANPC1RAB9A
SCHEMBL7972488 0.73 LMNA (0.41) ATMPLA2G7LMNANPC1RAB9A
SCHEMBL20104790 0.70 ATM (0.56) ATMPLA2G7LMNANPC1RAB9A
SCHEMBL21026012 0.70 ATM (0.56) ATMPLA2G7LMNANPC1RAB9A
SCHEMBL24265020 0.70 NPC1 (0.43) ATMPLA2G7LMNANPC1RAB9A
SCHEMBL8103778 0.69 ALOX15 (0.48) MEN1KMT2APPARAALDH1A1CYP1A2
SCHEMBL29097238 0.68 KMT2A (0.42) LMNASMN1; SMN2MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6313150-B1 FOR CONTROLLING PHYTOPATHOGENIC FUNGI SHIONOGI & CO., LTD. (JP) 2001-11-06 — — US disclosed
EP-0754672-B1 GAMMA-SUBSTITUTED PHENYLACETIC ACID DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND AGRICULTURAL BACTERICIDE CONTAINING THE SAME SHIONOGI & CO (JP) 2000-10-11 — — EP disclosed
US-5948819-A α-substituted phenylacetic acid derivative, its production and agricultural fungicide containing it SHIONOGI & CO., LTD (JP) 1999-09-07 — — US disclosed
EP-0754672-A1 GAMMA-SUBSTITUTED PHENYLACETIC ACID DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND AGRICULTURAL BACTERICIDE CONTAINING THE SAME SHIONOGI & CO., LTD. (JP) 1997-01-22 — — EP disclosed
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