SCHEMBL4248209

SCHEMBL4248209

O=[N+]([O-])c1cc(F)c(N2CCCSCC2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.49
ALDH1A1 P00352 6/20 0.49
KMT2A Q03164 1/20 0.40
THRB P10828 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.38
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
MAPK1 P28482 1/20 0.37
GAA P10253 3/20 0.36
POLB P06746 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL18396739 0.97 ALDH1A1 (0.44) MAPTALDH1A1KMT2AKDM4EPKM
SCHEMBL3043208 0.94 ALDH1A1 (0.54) MAPTALDH1A1KMT2ATHRBKDM4E
SCHEMBL28196822 0.86 ALDH1A1 (0.46) MAPTALDH1A1KMT2APKMLMNA
SCHEMBL18876391 0.84 MAPT (0.51) MAPTALDH1A1KMT2APKMLMNA
SCHEMBL4248193 0.82 ALDH1A1 (0.63) MAPTALDH1A1KMT2ATHRBLMNA
SCHEMBL23833822 0.79 MAPT (0.41) MAPTALDH1A1KMT2ATHRBKDM4E
SCHEMBL18396735 0.78 ALDH1A1 (0.66) MAPTALDH1A1KMT2ATHRBPKM
SCHEMBL4383340 0.77 MAPT (0.52) MAPTALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL28980384 0.76 ALDH1A1 (0.44) MAPTALDH1A1KMT2ATHRBPKM
SCHEMBL22698342 0.75 ALDH1A1 (0.38) MAPTALDH1A1KMT2AKDM4ELMNA

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
US-20090137553-A1 Thiazepine Oxazolidinones as Antibacterial Agents PHARMACIA AND UPJOHN COMPANY LLC (US) 2009-05-28 US disclosed
EP-1819702-A1 THIAZEPINE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-08-22 EP disclosed
WO-2006056875-A1 THIAZEPINE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-06-01 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 (1 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-20090137553-A1 Thiazepine Oxazolidinones as Antibacterial Agents OXA1L, TBCD, CLPP MAPT 2991/4885ALDH1A1 2766/4885KMT2A 4627/4885

“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.