SCHEMBL17423736

SCHEMBL17423736

O=C(CCl)c1c[nH]c2cc(Oc3cnccn3)ccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.59
▸ KMT2A Q03164 3/20 0.47
▸ LMNA P02545 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ MITF O75030 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ PRKAB2 O43741 2/20 0.41
▸ PRKAG1 P54619 2/20 0.41
▸ PRKAA2 P54646 2/20 0.41
▸ PRKAA1 Q13131 2/20 0.41
▸ PRKAG3 Q9UGI9 2/20 0.41
▸ PRKAG2 Q9UGJ0 2/20 0.41
▸ PRKAB1 Q9Y478 2/20 0.41
▸ CPT1A P50416 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ HTR2C P28335 1/20 0.39

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
SCHEMBL17423772 0.84 MAPT (0.62) MAPTKMT2ALMNARAB9AMEN1
SCHEMBL17423752 0.81 MAPT (0.68) MAPTKMT2ALMNARAB9AMEN1
SCHEMBL17597543 0.81 ALDH1A1 (0.41) MAPTKMT2ALMNAMEN1PRKAB2
SCHEMBL17913661 0.79 MAPT (0.38) MAPTKMT2ALMNARAB9AMEN1
SCHEMBL17423780 0.79 MAPT (0.54) MAPTKMT2ALMNARAB9AMEN1
SCHEMBL17913420 0.78 MAPT (0.41) MAPTKMT2ALMNARAB9AMEN1
SCHEMBL17913205 0.75 CPT1A (0.38) MAPTKMT2ALMNARAB9AMEN1
SCHEMBL18356500 0.75 KMT2A (0.55) MAPTKMT2ALMNARAB9AKDM4E
SCHEMBL27436910 0.75 MAPT (1.00) MAPTKMT2ALMNARAB9AMEN1
SCHEMBL17423750 0.74 LMNA (0.62) MAPTKMT2ALMNARAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016007837-A1 CARBONYL LINKED BICYCLIC HETEROARYL ANTIBIOTIC TOLERANCE INHIBITORS SPERO THERAPEUTICS, INC. (US) 2016-01-14 — — WO disclosed
WO-2016007837-A1 CARBONYL LINKED BICYCLIC HETEROARYL ANTIBIOTIC TOLERANCE INHIBITORS SPERO THERAPEUTICS, INC. (US) 2016-01-14 — — WO disclosed
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