SCHEMBL3033079

SCHEMBL3033079

O=C1C=CN(c2c(F)cc([N+](=O)[O-])cc2F)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 2/20 0.35
CYP2E1 P05181 1/20 0.34
POLB P06746 3/20 0.33
HIF1A Q16665 1/20 0.33
CYP19A1 P11511 1/20 0.32
MAPT P10636 4/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
THRB P10828 1/20 0.32
MEN1 O00255 2/20 0.31
TSHR P16473 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
DDB1 Q16531 1/20 0.30
CRBN Q96SW2 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL3043142 0.81 ALDH1A1 (0.60) ALDH1A1KMT2ALMNAPOLBHIF1A
SCHEMBL5945198 0.81 CYP2E1 (0.40) ALDH1A1KMT2ALMNACYP2E1HIF1A
SCHEMBL3032945 0.75 MAPT (0.47) ALDH1A1KMT2ALMNAPOLBMAPT
SCHEMBL5945308 0.74 MAPT (0.43) ALDH1A1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL239465 0.73 ALDH1A1 (0.66) ALDH1A1KMT2ALMNAPOLBHIF1A
SCHEMBL16701874 0.71 SMN1; SMN2 (0.46) ALDH1A1KMT2ALMNAPOLBHIF1A
SCHEMBL26981455 0.71 KMT2A (0.44) ALDH1A1KMT2ALMNAPOLBMAPT
SCHEMBL5945269 0.70 MAPT (0.42) ALDH1A1KMT2ALMNACYP2E1POLB
SCHEMBL5242045 0.70 ALDH1A1 (0.47) ALDH1A1KMT2ALMNAPOLBMAPT
SCHEMBL18876391 0.69 MAPT (0.51) ALDH1A1KMT2ALMNAPOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7645781-B2 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives PFIZER INC (US) 2010-01-12 US disclosed
US-20070015801-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives THOMAS RICHARD C 2007-01-18 US disclosed
US-7141588-B2 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives PFIZER, INC. (US) 2006-11-28 US disclosed
EP-1478629-B1 N-ARYL-2-OXAZOLIDINONE-5-CARBOXAMIDES AND THEIR DERIVATIVES AND THEIR USE AS ANTIBACTERIALS PHARMACIA & UPJOHN CO LLC (US) 2006-10-11 EP disclosed
US-7105547-B2 Antimicrobial 1-aryl dihydropyridone compounds PHARMACIA AND UPJOHN COMPANY (US) 2006-09-12 US disclosed
EP-1554273-A1 ANTIMICROBIAL 1-ARYL DIHYDROPYRIDONE COMPOUNDS Pharmacia & Upjohn Company LLC (US) 2005-07-20 EP disclosed
US-6919329-B2 N-Aryl-2-oxazolidinone-5-carboxamides and their derivatives PHARMACIA & UPJOHN COMPANY (US) 2005-07-19 US disclosed
US-20050070580-A1 Antimicrobial 1-aryl dihydropyridone compounds GORDEEV MIKHAIL FEDOR (US) 2005-03-31 US disclosed
EP-1478629-A1 N-ARYL-2-OXAZOLIDINONE-5-CARBOXAMIDES AND THEIR DERIVATIVES AND THEIR USE AS ANTIBACTERIALS PHARMACIA & UPJOHN COMPANY (US) 2004-11-24 EP disclosed
US-20040147760-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives PHARMACIA & UPJOHN COMPANY 2004-07-29 US disclosed
WO-2004033449-A1 ANTIMICROBIAL 1-ARYL DIHYDROPYRIDONE COMPOUNDS PHARMACIA & UPJOHN COMPANY LLC (US) 2004-04-22 WO disclosed
US-20040044052-A1 N-Aryl-2-oxazolidinone-5-carboxamides and their derivatives PHARMACIA & UPJOHN COMPANY 2004-03-04 US disclosed
WO-2003072553-A1 N-ARYL-2-OXAZOLIDINONE-5-CARBOXAMIDES AND THEIR DERIVATES AND THEIR USE AS ANTIBACTERIALS PHARMACIA & UPJOHN COMPANY (US) 2003-09-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040147760-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives OXA1L, AADAC, MT-ND5 ALDH1A1 956/4885KMT2A 1273/4885LMNA 3385/4885
US-20040044052-A1 N-Aryl-2-oxazolidinone-5-carboxamides and their derivatives OXA1L, AADAC, MT-ND5 ALDH1A1 956/4885KMT2A 1273/4885LMNA 3385/4885
US-20050070580-A1 Antimicrobial 1-aryl dihydropyridone compounds TLR1, QDPR, AP1S1 ALDH1A1 42/4885KMT2A 4246/4885LMNA 4798/4885
US-20070015801-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives OXA1L, AADAC, MT-ND5 ALDH1A1 956/4885KMT2A 1273/4885LMNA 3385/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.