SCHEMBL9092445

SCHEMBL9092445

O=Nc1ccc(NC2=CC(=O)C=CC2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.48
▸ HTT P42858 4/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ DNM1 Q05193 1/20 0.43
▸ CASP3 P42574 4/20 0.32
▸ SENP7 Q9BQF6 4/20 0.32
▸ SENP6 Q9GZR1 4/20 0.32
▸ MAPT P10636 4/20 0.32
▸ MAPK1 P28482 4/20 0.32
▸ KMT2A Q03164 4/20 0.32
▸ SENP8 Q96LD8 3/20 0.32
▸ BLM P54132 3/20 0.32
▸ LMNA P02545 3/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ L3MBTL1 Q9Y468 3/20 0.32
▸ RAB9A P51151 3/20 0.32
▸ TP53 P04637 2/20 0.32

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
SCHEMBL11805322 0.78 DNM1 (0.71) ALDH1A1HTTTDP1TSHRCYP3A4
SCHEMBL9560460 0.78 IDO1 (0.49) ALDH1A1TDP1CYP3A4DNM1MAPT
SCHEMBL2037194 0.77 MAPT (0.52) ALDH1A1HTTHSD17B10TDP1TSHR
SCHEMBL29098353 0.74 DNM1 (0.46) ALDH1A1HTTTDP1TSHRDNM1
SCHEMBL27491991 0.72 KMT2A (0.57) ALDH1A1CASP3SENP7SENP6KMT2A
SCHEMBL7032650 0.72 L3MBTL1 (0.51) ALDH1A1HTTHSD17B10TDP1DNM1
SCHEMBL655572 0.66 ALDH1A1 (1.00) ALDH1A1HTTHSD17B10TDP1TSHR
SCHEMBL29098362 0.66 CYP3A4 (0.50) ALDH1A1HSD17B10TSHRCYP3A4DNM1
SCHEMBL28013507 0.65 ALDH1A1 (0.58) ALDH1A1HTTHSD17B10TDP1TSHR
SCHEMBL9221118 0.65 ALDH1A1 (0.65) ALDH1A1HTTHSD17B10TDP1TSHR

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
US-5484708-A DETERMINATION OF GLUCOSE BOEHRINGER MANNHEIM GMBH (DE) 1996-01-16 — — US disclosed
US-5445943-A Reduction of an aromatic nitrosoaniline compound to a colored quinone diimine BOEHRINGER MANNHEIM GMBH (DE) 1995-08-29 — — US disclosed
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