SCHEMBL11594686

SCHEMBL11594686

Cc1ccc(C(=O)Nc2cccc(C(=O)O)c2C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.63
▸ RAB9A P51151 5/20 0.63
▸ SLC16A3 O15427 1/20 0.59
▸ MEN1 O00255 5/20 0.58
▸ KMT2A Q03164 5/20 0.58
▸ TDP1 Q9NUW8 2/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ MAPT P10636 1/20 0.58
▸ HTT P42858 1/20 0.58
▸ PPARG P37231 1/20 0.56
▸ NR1H4 Q96RI1 1/20 0.56
▸ DHODH Q02127 1/20 0.55
▸ GFER P55789 1/20 0.55
▸ CASP3 P42574 2/20 0.54
▸ SENP8 Q96LD8 2/20 0.54
▸ SENP7 Q9BQF6 2/20 0.54
▸ SENP6 Q9GZR1 2/20 0.54
▸ SIRT5 Q9NXA8 1/20 0.54
▸ AKR1C3 P42330 1/20 0.53
▸ PKM P14618 1/20 0.53

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
SCHEMBL7832216 0.87 MEN1 (0.68) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL15823215 0.86 DHODH (0.73) NPC1RAB9ASLC16A3MEN1KMT2A
SCHEMBL11590186 0.85 SUCNR1 (0.58) NPC1RAB9AMEN1KMT2ADHODH
SCHEMBL11592326 0.84 F10 (0.66) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL6240737 0.84 MEN1 (0.68) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL11594005 0.84 KDM4E (0.58) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL14856050 0.83 DHODH (0.69) NPC1RAB9ASLC16A3MEN1KMT2A
SCHEMBL24312443 0.81 NPC1 (0.69) NPC1RAB9ASLC16A3MEN1KMT2A
SCHEMBL6848585 0.80 NPC1 (0.54) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL14128773 0.80 NPC1 (0.83) NPC1RAB9AMEN1KMT2ATDP1

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
US-4088651-A Acylamino quinophthalone compounds BAYER AKTIENGESELLSCHAFT (DT) 1978-05-09 — — US disclosed
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