SCHEMBL9890812

SCHEMBL9890812

O=C(COc1ccccc1)Nc1ccc(OCc2ccccc2)c(F)c1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.63
SMN1; SMN2 Q16637 3/20 0.57
NPC1 O15118 4/20 0.55
ALDH1A1 P00352 2/20 0.55
RAB9A P51151 2/20 0.55
MAPK1 P28482 1/20 0.53
MAPT P10636 2/20 0.53
KDM4E B2RXH2 1/20 0.53
POLB P06746 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
LTA4H P09960 1/20 0.52

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
SCHEMBL12203142 0.84 MRGPRX4 (0.52) FFAR1NPC1
SCHEMBL2745096 0.82 PTPN1 (0.55) FFAR1NPC1
SCHEMBL705457 0.81 MGLL (0.58) FFAR1SMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL24968812 0.79 EGFR (0.54) FFAR1NPC1ALDH1A1RAB9A
SCHEMBL31503975 0.77 LMNA (0.78) NPC1ALDH1A1RAB9AMAPK1MAPT
SCHEMBL371996 0.76 ALDH1A1 (0.67) FFAR1ALDH1A1MAPTKDM4EPOLB
SCHEMBL29693563 0.76 ALDH1A1 (0.67) FFAR1ALDH1A1MAPTKDM4EPOLB
SCHEMBL372306 0.76 POLB (0.64) FFAR1SMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL20620003 0.76 MEN1 (0.71) SMN1; SMN2NPC1ALDH1A1RAB9AMAPT
SCHEMBL13615636 0.74 MET (0.59)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501774-B2 Oxazolidinone-quinolone hybrid antibiotics Morphochem Aktiengesellschaft für kombinatorische Chemie (DE) 2013-08-06 US disclosed
US-8501774-B2 Oxazolidinone-quinolone hybrid antibiotics Morphochem Aktiengesellschaft für kombinatorische Chemie (DE) 2013-08-06 US disclosed
US-20120142635-A1 OXAZOLIDINONE-QUINOLONE HYBRID ANTIBIOTICS MORPHOCHEM AKTIENGESELLSCHAFT FUR KOMBINATORISCHE CHEMIE (DE) 2012-06-07 US disclosed
US-20120142635-A1 OXAZOLIDINONE-QUINOLONE HYBRID ANTIBIOTICS MORPHOCHEM AKTIENGESELLSCHAFT FUR KOMBINATORISCHE CHEMIE (DE) 2012-06-07 US 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-20120142635-A1 OXAZOLIDINONE-QUINOLONE HYBRID ANTIBIOTICS OXA1L, TOP1, TOP2A FFAR1 4745/4885SMN1; SMN2 4448/4885NPC1 2291/4885

“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.