SCHEMBL7072105

SCHEMBL7072105

N#Cc1ccc(C=C(F)C(=O)O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ PKM P14618 1/20 0.51
▸ ATM Q13315 1/20 0.51
▸ MAPT P10636 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ FBP1 P09467 3/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ CISD1 Q9NZ45 1/20 0.43
▸ SLC16A3 O15427 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ SLC16A1 P53985 1/20 0.43
▸ GPR35 Q9HC97 1/20 0.43
▸ EGFR P00533 1/20 0.43
▸ HDAC2 Q92769 1/20 0.42
▸ P4HB P07237 1/20 0.41

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
SCHEMBL7072104 1.00 KDM4E (0.51) KDM4EALDH1A1KMT2APKMATM
SCHEMBL2241924 0.81 ALDH1A1 (0.54) KDM4EALDH1A1KMT2APKMATM
SCHEMBL1225860 0.81 ALDH1A1 (0.54) KDM4EALDH1A1KMT2APKMATM
SCHEMBL5202339 0.81 TP53 (0.55) KDM4EALDH1A1KMT2APKMATM
SCHEMBL28499060 0.80 FBP1 (0.46) KDM4EALDH1A1KMT2APKMATM
SCHEMBL30754354 0.80 FBP1 (0.52) KDM4EFBP1P4HB
SCHEMBL3246531 0.79 AKR1C3 (0.62) KDM4EALDH1A1KMT2APKMATM
SCHEMBL20764492 0.79 AKR1C3 (0.62) KDM4EALDH1A1KMT2APKMATM
SCHEMBL4579424 0.79 AKR1C3 (0.62) KDM4EALDH1A1KMT2APKMATM
SCHEMBL26604322 0.78 FBP1 (0.50) KDM4EALDH1A1KMT2APKMATM

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
EP-0946492-B1 NOVEL 2-FLUOROACRYLIC ACID DERIVATIVES, NOVEL MIXTURES OF HERBICIDES AND ANTIDOTES AND THE USE THEREOF BAYER CROPSCIENCE GMBH (DE) 2003-06-18 — — EP claimed
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