SCHEMBL6848512

SCHEMBL6848512

O=C(O)c1ccccc1NC(=O)c1cccc(C(=O)O)c1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.65
▸ MEN1 O00255 5/20 0.65
▸ PKM P14618 1/20 0.65
▸ DHODH Q02127 1/20 0.58
▸ PBRM1 Q86U86 1/20 0.53
▸ NPC1 O15118 4/20 0.53
▸ RAB9A P51151 4/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ HPGD P15428 2/20 0.53
▸ CA12 O43570 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ CA9 Q16790 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ CASP3 P42574 1/20 0.53
▸ SENP8 Q96LD8 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ SENP7 Q9BQF6 1/20 0.53
▸ SENP6 Q9GZR1 1/20 0.53
▸ LMNA P02545 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL6848585 0.91 NPC1 (0.54) KMT2AMEN1PKMDHODHPBRM1
SCHEMBL11086880 0.87 HSD17B10 (0.62) KMT2AMEN1PKMNPC1RAB9A
SCHEMBL6847188 0.86 NPC1 (0.53) KMT2AMEN1PKMDHODHPBRM1
SCHEMBL2058331 0.85 ALDH1A1 (0.68) KMT2AMEN1PKMDHODHNPC1
SCHEMBL6841680 0.84 ALDH1A1 (0.72) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL7832216 0.81 MEN1 (0.68) KMT2AMEN1PKMDHODHNPC1
SCHEMBL11594362 0.80 CYP1A2 (0.68) KMT2AMEN1PBRM1NPC1RAB9A
SCHEMBL11405554 0.80 LMNA (0.76) KMT2AMEN1PKMDHODHNPC1
SCHEMBL4669122 0.80 LMNA (0.76) KMT2AMEN1PKMDHODHNPC1
SCHEMBL15183709 0.80 KMT2A (0.77) KMT2AMEN1PKMDHODHNPC1

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-6767983-B1 SILICONE RESINS HAVING SPECIFIED TRIORGANOSILYL GROUP LINKED TO ALL OR PART OF ENDS OF BACKBONE CHAIN OF POLYSILSESQUIOXANES; PHOTORESISTS NIPPON STEEL CHEMICAL CO., LTD. (JP) 2004-07-27 — — US disclosed
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