SCHEMBL6984296

SCHEMBL6984296

CC(OCc1[nH]c(-c2ccccc2)nc1Br)[Si](C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.37
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
GAA P10253 2/20 0.36
TP53 P04637 5/20 0.36
MAPT P10636 5/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
NFKB1 P19838 2/20 0.36
NFKB2 Q00653 2/20 0.36
RELA Q04206 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
GRIN2B Q13224 1/20 0.35
MAPK13 O15264 3/20 0.35
MAPK12 P53778 3/20 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
SCHEMBL7481728 0.70 TSHR (0.41) POLBNPC1RAB9AGAATP53
SCHEMBL2145943 0.65 MAPK13 (0.49) POLBNPC1RAB9AGAATP53
SCHEMBL7566204 0.64 DGAT1 (0.39) NPC1RAB9AGAATP53MAPT
SCHEMBL8075160 0.62 KDM4E (0.49) POLBNPC1RAB9AGAATP53
SCHEMBL6368800 0.62 POLB (0.44) POLBGAATP53MAPTKDM4E
SCHEMBL13115444 0.61 MAPK14 (0.53) POLBNPC1RAB9ATP53MAPT
SCHEMBL8678102 0.61 KDM4E (0.51) POLBGAATP53MAPTKDM4E
SCHEMBL33678 0.60 KDM4E (0.50) POLBNPC1RAB9AGAATP53
SCHEMBL7140146 0.60 BRAF (0.52) POLBGAATP53MAPTKDM4E
SCHEMBL6373718 0.59 GCGR (0.57) POLBTP53MAPTMAPK13MAPK12

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-1224180-B1 SUBSTITUTED AZOLES NOVARTIS AG (CH) 2003-07-02 EP disclosed
US-6579874-B2 P38 MAP kinase inhibitors; treating Tumor necrosis factor (TNF-alpha) and Interleukin-1 mediated diseases, such as rheumatoid arthritis; imidazole and oxazole derivatives NOVARTIS AG (CH) 2003-06-17 US disclosed
US-20020049220-A1 Substituted azoles NOVARTIS AG (CH) 2002-04-25 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-20020049220-A1 Substituted azoles MAPK1, MAPK4, MAP3K1 POLB 4252/4885NPC1 3073/4885RAB9A 1548/4885

“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.