SCHEMBL6558245

SCHEMBL6558245

CCOC(Cn1c(-c2ccc([N+](=O)[O-])cc2)ncc(C(=O)O)c1=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.40
SMN1; SMN2 Q16637 5/20 0.40
ALDH1A1 P00352 4/20 0.40
RAB9A P51151 3/20 0.40
ELANE P08246 1/20 0.39
HTT P42858 3/20 0.39
LMNA P02545 3/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
RXFP1 Q9HBX9 2/20 0.39
NLRP3 Q96P20 2/20 0.39
POLB P06746 1/20 0.39
NPC1 O15118 1/20 0.38
NPBWR1 P48145 1/20 0.38
MCHR1 Q99705 1/20 0.38
AR P10275 2/20 0.38
APOBEC3G Q9HC16 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37

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
SCHEMBL6556255 0.91 MAPT (0.46) MAPTSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL6556372 0.90 AKR1B1 (0.36) MAPTSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL6556282 0.87 KDM4E (0.38) MAPTSMN1; SMN2ALDH1A1RAB9AKDM4E
SCHEMBL6556361 0.86 MAPT (0.42) MAPTSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL6557511 0.85 P2RX3 (0.41) MAPTSMN1; SMN2ALDH1A1RAB9ALMNA
SCHEMBL6556234 0.85 ELANE (0.39) ALDH1A1ELANEKDM4ERXFP1
SCHEMBL6558138 0.84 KDM4E (0.50) SMN1; SMN2ALDH1A1RAB9AELANEHTT
SCHEMBL6556504 0.84 CSNK1D (0.37) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL6556267 0.81 FOS (0.43) MAPTSMN1; SMN2ALDH1A1RAB9ALMNA
SCHEMBL6557546 0.80 CTRC (0.42) MAPTALDH1A1KDM4EMEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0826671-B1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
US-5948785-A USEFUL AS CHYMASE INHIBITORS AND CAN BE EFFECTIVE FOR THE PROPHYLAXIS AND TREATMENT OF VARIOUS DISEASES CAUSED BY CHYMASE, SUCH AS THOSE CAUSED BY ANGIOTENSIN II. THE GREEN CROSS CORPORATION (JP) 1999-09-07 US disclosed
EP-0826671-A1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME THE GREEN CROSS CORPORATION (JP) 1998-03-04 EP disclosed