SCHEMBL22664035

SCHEMBL22664035

O=C/C=C\C(=O)Nc1nc2cc(NC(=O)/C=C\C(=O)O)ccc2o1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.54
▸ KDM4E B2RXH2 6/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ MAPT P10636 5/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ LPAR2 Q9HBW0 2/20 0.45
▸ LPAR1 Q92633 1/20 0.45
▸ LPAR3 Q9UBY5 1/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ THRB P10828 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ TDP2 O95551 1/20 0.42
▸ POLB P06746 3/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ IL6 P05231 1/20 0.41
▸ STAT3 P40763 1/20 0.41
▸ NMT1 P30419 1/20 0.41
▸ PKM P14618 2/20 0.41
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 3/20 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
SCHEMBL22658673 0.93 ALDH1A1 (0.58) ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL22664020 0.85 PPARG (0.54) ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL22663680 0.77 ALDH1A1 (0.60) ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL22663783 0.76 NPC1 (0.59) ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL22658725 0.68 NPC1 (0.67) ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL11133691 0.67 LPAR2 (0.88) ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL11137034 0.67 LPAR2 (0.88) ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL22664021 0.66 LPAR2 (0.85) ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL3620968 0.66 MAPT (0.66) KMT2AMAPTSMN1; SMN2THRBGAA
SCHEMBL3620965 0.66 MAPT (0.66) KMT2AMAPTSMN1; SMN2THRBGAA

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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