SCHEMBL22664020

SCHEMBL22664020

O=C/C=C\C(=O)Nc1ccc(-c2nc3cc(NC(=O)/C=C\C(=O)O)ccc3o2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.54
▸ HPSE Q9Y251 7/20 0.54
▸ ALDH1A1 P00352 7/20 0.54
▸ KDM4E B2RXH2 6/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ NPC1 O15118 3/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ POLB P06746 1/20 0.54
▸ MAPT P10636 6/20 0.53
▸ KMT2A Q03164 3/20 0.51
▸ HPGD P15428 4/20 0.51
▸ HSD17B10 Q99714 4/20 0.51
▸ NPSR1 Q6W5P4 2/20 0.51
▸ TSHR P16473 2/20 0.51
▸ GLA P06280 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ USP2 O75604 1/20 0.51
▸ TP53 P04637 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ THRB P10828 1/20 0.50

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
SCHEMBL22663680 0.93 ALDH1A1 (0.60) PPARGHPSEALDH1A1KDM4ESMN1; SMN2
SCHEMBL22663783 0.91 NPC1 (0.59) PPARGHPSEALDH1A1KDM4ESMN1; SMN2
SCHEMBL22664035 0.85 ALDH1A1 (0.54) PPARGALDH1A1KDM4ESMN1; SMN2NPC1
SCHEMBL22658725 0.84 NPC1 (0.67) PPARGHPSEALDH1A1KDM4ESMN1; SMN2
SCHEMBL22658673 0.78 ALDH1A1 (0.58) PPARGALDH1A1KDM4ESMN1; SMN2NPC1
SCHEMBL2248018 0.76 HPSE (0.74) HPSEALDH1A1KDM4ESMN1; SMN2NPC1
SCHEMBL2248014 0.76 HPSE (0.74) HPSEALDH1A1KDM4ESMN1; SMN2NPC1
SCHEMBL2244809 0.75 NPC1 (0.85) ALDH1A1KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL2246191 0.73 ALDH1A1 (0.76) PPARGHPSEALDH1A1KDM4ESMN1; SMN2
SCHEMBL2243174 0.70 NPC1 (1.00) ALDH1A1KDM4ESMN1; SMN2NPC1RAB9A

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
WO-2020232338-A1 POSITIVE TONE PHOTOSENSITIVE COMPOSITIONS CONTAINING AMIC ACID AS LATENT BASE CATALYST PROMERUS, LLC (US) 2020-11-19 — — WO disclosed
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