SCHEMBL6085522

SCHEMBL6085522

CC(=O)N(c1cccc(-c2n[nH]cc2-c2nc3ccc(C)cc3o2)c1)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.41
RAB9A P51151 7/20 0.41
MAPT P10636 8/20 0.41
SMN1; SMN2 Q16637 6/20 0.41
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 4/20 0.41
HPGD P15428 4/20 0.41
HSD17B10 Q99714 4/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
ATM Q13315 1/20 0.41
GPR119 Q8TDV5 2/20 0.41
P2RY6 Q15077 1/20 0.41
TP53 P04637 5/20 0.41
CETP P11597 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL6085882 0.85 HDAC6 (0.39) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6083677 0.80 NPC1 (0.57) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6084801 0.80 MAPT (0.43) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6085518 0.79 NPC1 (0.43) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6086325 0.79 NPC1 (0.42) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6085535 0.78 NPC1 (0.59) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6085544 0.78 NPC1 (0.56) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6084746 0.77 NPC1 (0.56) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6085394 0.76 MAPT (0.58) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6670101 0.75 NPC1 (0.42) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105535-B2 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2006-09-12 US claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
US-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2004-09-16 US claimed
US-7105535-B2 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2006-09-12 US disclosed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP disclosed
US-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2004-09-16 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-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors MAP3K15, MAP3K20, MAP3K3 NPC1 4031/4885RAB9A 2584/4885MAPT 801/4885

“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.