SCHEMBL17423792

SCHEMBL17423792

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

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.64
NR4A2 P43354 2/20 0.63
LMNA P02545 3/20 0.56
RAB9A P51151 2/20 0.56
ALDH1A1 P00352 3/20 0.54
MAPK1 P28482 1/20 0.54
HIF1A Q16665 1/20 0.54
F7 P08709 1/20 0.54
F3 P13726 1/20 0.54
GPR84 Q9NQS5 1/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
MITF O75030 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
AVPR1A P37288 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
PYGL P06737 1/20 0.47
HTT P42858 1/20 0.44
HAT1 O14929 2/20 0.43
EP300 Q09472 2/20 0.43

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
SCHEMBL13533538 0.87 NR4A2 (0.64) MAPTNR4A2LMNARAB9AALDH1A1
SCHEMBL3443344 0.87 F7 (0.73) MAPTNR4A2LMNARAB9AALDH1A1
SCHEMBL30392504 0.84 F7 (0.74) NR4A2LMNAALDH1A1MAPK1F7
SCHEMBL613332 0.84 F7 (0.74) NR4A2LMNAALDH1A1MAPK1F7
SCHEMBL3195663 0.83 NR4A2 (0.59) MAPTNR4A2LMNARAB9AALDH1A1
SCHEMBL28709470 0.83 NR4A2 (0.56) MAPTNR4A2LMNARAB9AALDH1A1
Ammonia Solution, Strong SCHEMBL4556453 0.83 F7 (0.72) NR4A2LMNAALDH1A1MAPK1F7
SCHEMBL30275070 0.82 MAPT (0.62) MAPTLMNARAB9AGPR84MEN1
SCHEMBL26204498 0.81 NR4A2 (0.65) MAPTNR4A2ALDH1A1F7F3
SCHEMBL3182218 0.81 NR4A2 (0.69) MAPTNR4A2ALDH1A1F7F3

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