SCHEMBL8104417

SCHEMBL8104417

O=C(O)COCc1cccc([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.54
MAOA P21397 1/20 0.54
RAB9A P51151 1/20 0.53
TSHR P16473 1/20 0.53
ALDH1A1 P00352 3/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
RXFP1 Q9HBX9 1/20 0.50
FFAR1 O14842 1/20 0.50
AKR1B1 P15121 1/20 0.49
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TP53 P04637 1/20 0.49

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
SCHEMBL7222841 0.87 TSHR (0.55) MAOBMAOARAB9ATSHRALDH1A1
SCHEMBL1767329 0.85 TSHR (0.65) MAOBMAOARAB9ATSHRALDH1A1
SCHEMBL21647759 0.85 TSHR (0.50) MAOBMAOARAB9ATSHRALDH1A1
SCHEMBL30408348 0.85 TSHR (0.50) MAOBMAOARAB9ATSHRALDH1A1
SCHEMBL26343368 0.84 SMN1; SMN2 (0.42) RAB9AALDH1A1KMT2AMEN1GAA
SCHEMBL7861196 0.84 TSHR (0.59) MAOBMAOARAB9ATSHRALDH1A1
SCHEMBL18714233 0.83 TSHR (0.57) MAOBMAOARAB9ATSHRALDH1A1
SCHEMBL11632216 0.81 RAB9A (0.62) MAOBMAOARAB9ATSHRALDH1A1
SCHEMBL8114222 0.81 MAOB (0.51) MAOBMAOARAB9ATSHRALDH1A1
SCHEMBL5278978 0.81 IDO1 (0.56) MAOBRAB9ATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240027902-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-01-25 US disclosed
US-20230359119-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-09 US disclosed
US-20230305393-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-28 US disclosed
US-20230305394-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-28 US disclosed
US-9732073-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
EP-0590885-B1 Antibiotic carbapenem compounds ZENECA LTD (GB) 2000-03-15 EP disclosed
US-5527791-A Carbapenem antibiotic compounds ZENECA LIMITED (GB) 1996-06-18 US disclosed
EP-0590885-A1 Antibiotic carbapenem compounds ZENECA LIMITED (GB) 1994-04-06 EP disclosed