SCHEMBL19385386

SCHEMBL19385386

Cc1[nH]c2ccccc2c1N=[N+]=[N-]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.50
▸ MEN1 O00255 7/20 0.50
▸ KMT2A Q03164 7/20 0.50
▸ GAA P10253 4/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ NPSR1 Q6W5P4 2/20 0.50
▸ AHR P35869 1/20 0.50
▸ ALDH1A1 P00352 6/20 0.46
▸ POLB P06746 3/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ GFER P55789 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ MAPK1 P28482 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ CYP3A4 P08684 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ KDM4E B2RXH2 2/20 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
SCHEMBL28882768 0.79 ALDH1A1 (0.40) MAPTMEN1KMT2AGAASMN1; SMN2
SCHEMBL19400880 0.77 ESR1 (0.50) MAPTMEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL11174102 0.76 AHR (0.55) MAPTMEN1KMT2AGAASMN1; SMN2
SCHEMBL28245664 0.75 KIF11 (0.39) MAPTMEN1KMT2AGAASMN1; SMN2
SCHEMBL19385398 0.73 KDM4E (0.51) MAPTMEN1KMT2AGAANPSR1
SCHEMBL19385394 0.73 KDM4E (0.51) MAPTMEN1KMT2AGAANPSR1
SCHEMBL19385396 0.73 GAA (0.62) MAPTGAAALDH1A1HPGDTSHR
SCHEMBL7905132 0.71 MAPT (0.77) MAPTMEN1KMT2AGAASMN1; SMN2
SCHEMBL7905135 0.71 MAPT (0.77) MAPTMEN1KMT2AGAASMN1; SMN2
SCHEMBL29789603 0.70 KIF11 (0.49) MAPTMEN1KMT2ANPSR1AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017163263-A1 INDOLE DERIVATIVES, PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-09-28 — — WO claimed
WO-2017163263-A1 INDOLE DERIVATIVES, PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-09-28 — — WO disclosed
WO-2017163263-A1 INDOLE DERIVATIVES, PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-09-28 — — WO disclosed
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