SCHEMBL9168922

SCHEMBL9168922

Nc1cc(Cl)cnc1Oc1ccc(OCCC(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
TSHR P16473 2/20 0.47
LMNA P02545 1/20 0.47
CYP2C9 P11712 1/20 0.47
APEX1 P27695 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
MAPK1 P28482 1/20 0.45
MCL1 Q07820 1/20 0.43
LIPE Q05469 4/20 0.41
FFAR4 Q5NUL3 1/20 0.41
MMP2 P08253 1/20 0.41
BCHE P06276 1/20 0.41
PRKAB2 O43741 1/20 0.41
PRKAG1 P54619 1/20 0.41
PRKAA2 P54646 1/20 0.41
PRKAA1 Q13131 1/20 0.41
PRKAG3 Q9UGI9 1/20 0.41
PRKAG2 Q9UGJ0 1/20 0.41
PRKAB1 Q9Y478 1/20 0.41
LTA4H P09960 3/20 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
SCHEMBL8684051 0.87 SMN1; SMN2 (0.65) SMN1; SMN2TSHRLMNACYP2C9APEX1
SCHEMBL7885684 0.85 LTA4H (0.52) SMN1; SMN2TSHRLMNACYP2C9APEX1
SCHEMBL8688733 0.85 L3MBTL1 (0.52) SMN1; SMN2TSHRLMNACYP2C9APEX1
SCHEMBL10499451 0.78 MAPK1 (0.71) SMN1; SMN2TSHRLMNACYP2C9APEX1
SCHEMBL14513363 0.77 SMN1; SMN2 (0.61) SMN1; SMN2TSHRLMNACYP2C9APEX1
SCHEMBL306371 0.77 CYP2C9 (0.56) SMN1; SMN2TSHRLMNACYP2C9APEX1
SCHEMBL8689392 0.77 SMN1; SMN2 (0.48) SMN1; SMN2TSHRLMNACYP2C9APEX1
SCHEMBL9168919 0.76 MAP4K4 (0.54) SMN1; SMN2TSHRLMNACYP2C9APEX1
SCHEMBL8683713 0.76 LIPE (0.52) LMNAL3MBTL1MCL1LIPEMMP2
SCHEMBL8582394 0.76 L3MBTL1 (0.61) L3MBTL1MCL1FFAR4MMP2LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5274100-A Process for the preparation of (3-fluoropyridin-2-yloxy)phenoxypropionic acids CIBA-GEIGY CORPORATION (US) 1993-12-28 US claimed
EP-0483061-A2 Process for the preparation of 4-(3-fluoro-pyridine-2-yloxy)-phenoxy-propionic acids CIBA-GEIGY AG (CH) 1992-04-29 EP claimed
EP-0483061-B1 Process for the preparation of 4-(3-fluoro-pyridine-2-yloxy)-phenoxy-propionic acids CIBA GEIGY AG (CH) 1995-05-17 EP disclosed
US-5274100-A Process for the preparation of (3-fluoropyridin-2-yloxy)phenoxypropionic acids CIBA-GEIGY CORPORATION (US) 1993-12-28 US disclosed
EP-0483061-A2 Process for the preparation of 4-(3-fluoro-pyridine-2-yloxy)-phenoxy-propionic acids CIBA-GEIGY AG (CH) 1992-04-29 EP disclosed