SCHEMBL2785392

SCHEMBL2785392

COc1cccc(SNC(=O)Nc2noc3cc(Cl)ccc23)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
TP53 P04637 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41
TUBA3E Q6PEY2 1/20 0.41
TUBA1A Q71U36 1/20 0.41
TUBA1C Q9BQE3 1/20 0.41
TUBB6 Q9BUF5 1/20 0.41
TUBB2B Q9BVA1 1/20 0.41
TUBB1 Q9H4B7 1/20 0.41
HIF1A Q16665 1/20 0.40
ALOX15 P16050 1/20 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
SCHEMBL2787441 0.89 TP53 (0.47) MAPTTP53SMN1; SMN2HIF1AALOX15
SCHEMBL2437430 0.80 SMN1; SMN2 (0.57) MAPTTP53SMN1; SMN2TSHRKMT2A
SCHEMBL2786321 0.79 TP53 (0.44) TP53SMN1; SMN2ALOX15TSHRKCNJ6
SCHEMBL2787210 0.77 KIT (0.41) MAPTTP53SMN1; SMN2HIF1AALDH1A1
SCHEMBL2785764 0.76 ABCC9 (0.45) MAPTTP53SMN1; SMN2ALOX15TSHR
SCHEMBL2787058 0.75 TP53 (0.46) MAPTTP53SMN1; SMN2HIF1AALOX15
SCHEMBL2768640 0.75 MAPT (0.50) MAPTSMN1; SMN2HIF1AKMT2AALDH1A1
SCHEMBL2787344 0.73 TP53 (0.50) MAPTTP53SMN1; SMN2HIF1AALOX15
SCHEMBL2784161 0.73 STK17B (0.41) MAPTTP53SMN1; SMN2LMNAALDH1A1
SCHEMBL2785867 0.71 SMN1; SMN2 (0.47) MAPTTP53SMN1; SMN2HIF1AALOX15

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-1881967-B1 SUBSTITUTED BENZO(D)ISOXAZOL-3-YL AMINE COMPOUNDS AS ANALGESICS GRUENENTHAL GMBH (DE) 2010-04-28 EP claimed