SCHEMBL6207437

SCHEMBL6207437

COc1ccc(-c2nc(C(=O)N3CCCCC3)oc2-c2ccc(OCc3ccccc3)cc2)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
PABPC1 P11940 1/20 0.46
RAB9A P51151 6/20 0.44
NPC1 O15118 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
ALDH1A1 P00352 3/20 0.44
TP53 P04637 3/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
HPGD P15428 1/20 0.44
PPARD Q03181 2/20 0.42
SCN9A Q15858 1/20 0.41
GABRA5 P31644 2/20 0.41
NMT1 P30419 1/20 0.41
MCHR1 Q99705 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
PPARA Q07869 1/20 0.40
CASP3 P42574 1/20 0.40

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
SCHEMBL6539351 0.90 RAB9A (0.53) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL6392729 0.88 HPGD (0.46) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL6539876 0.86 HPGD (0.50) RAB9ANPC1HPGDPPARDGABRA5
SCHEMBL6208143 0.86 MEN1 (0.53) KMT2AMEN1PABPC1PPARDFFAR4
Hydrochloric Acid SCHEMBL6540413 0.85 HPGD (0.44) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL6539699 0.85 HPGD (0.43) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL6539675 0.85 MEN1 (0.51) KMT2AMEN1PABPC1ALDH1A1PPARD
SCHEMBL6539344 0.82 HPGD (0.42) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL6539753 0.82 MEN1 (0.48) KMT2AMEN1PABPC1NPC1ALDH1A1
SCHEMBL6539690 0.82 HPGD (0.42) KMT2AMEN1RAB9ANPC1SMN1; SMN2

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
EP-1583749-A1 OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE Astellas Pharma Inc. (JP) 2005-10-12 EP disclosed
US-20040157891-A1 Inhibitor of cox FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 US disclosed
WO-2004065374-A1 OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE ASTELLAS PHARMA INC. (JP) 2004-08-05 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-20040157891-A1 Inhibitor of cox PTGS1, PTGS2, PTGES2 KMT2A 3081/4885MEN1 4420/4885PABPC1 2765/4885

“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.