SCHEMBL3037813

SCHEMBL3037813

Nc1ccc(N2C=CC(=O)CC2)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
MAPT P10636 5/20 0.45
GFER P55789 2/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CYP2E1 P05181 1/20 0.35
ATAD2 Q6PL18 1/20 0.35
SLC6A9 P48067 1/20 0.34
GPR55 Q9Y2T6 1/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
THRB P10828 2/20 0.33
HSD17B10 Q99714 2/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
ALOX15 P16050 1/20 0.33
YWHAG P61981 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL5945275 0.79 CYP2E1 (0.36) ALDH1A1CYP2E1KMT2ASMN1; SMN2
SCHEMBL5838810 0.78 CYP2E1 (0.39) CYP2E1SMN1; SMN2
SCHEMBL3043142 0.78 ALDH1A1 (0.60) ALDH1A1MAPTLMNAMAPK1TDP1
SCHEMBL3037946 0.76 DDB1 (0.43) ALDH1A1MAPTGFERLMNAMAPK1
SCHEMBL5622578 0.73 ALDH1A1 (0.59) ALDH1A1MAPTGFERLMNAMAPK1
SCHEMBL5839414 0.73 CYP2E1 (0.50) LMNACYP2E1
SCHEMBL3046131 0.73 MAOA (0.54) LMNA
Hydrochloric Acid SCHEMBL5838389 0.73 CYP2E1 (0.49) LMNACYP2E1
Hydrochloric Acid SCHEMBL5838900 0.73 CYP2E1 (0.49) LMNACYP2E1
SCHEMBL5653277 0.73 KMT2A (0.50) ALDH1A1MAPTGFERLMNAMAPK1

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 956/4885MAPT 4491/4885GFER 3037/4885
US-20040044052-A1 N-Aryl-2-oxazolidinone-5-carboxamides and their derivatives OXA1L, AADAC, MT-ND5 ALDH1A1 956/4885MAPT 4491/4885GFER 3037/4885
US-20050070580-A1 Antimicrobial 1-aryl dihydropyridone compounds TLR1, QDPR, AP1S1 ALDH1A1 42/4885MAPT 3593/4885GFER 2720/4885
US-20070015801-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives OXA1L, AADAC, MT-ND5 ALDH1A1 956/4885MAPT 4491/4885GFER 3037/4885

“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.