SCHEMBL4789541

SCHEMBL4789541

Oc1ccc(-c2ccc3ncnc(Nc4ccc(N5CCOCC5)cc4)c3c2)cc1F

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.66
HTT P42858 2/20 0.66
MAPK1 P28482 1/20 0.66
AHR P35869 1/20 0.66
PI4KB Q9UBF8 1/20 0.65
RAF1 P04049 9/20 0.53
BRAF P15056 9/20 0.53
IRAK4 Q9NWZ3 1/20 0.51
TTBK1 Q5TCY1 1/20 0.51
TTBK2 Q6IQ55 1/20 0.51
MAPKAPK2 P49137 1/20 0.50
NPC1 O15118 1/20 0.50
POLB P06746 1/20 0.50
RAB9A P51151 1/20 0.50
MEN1 O00255 1/20 0.49
USP2 O75604 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49

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
SCHEMBL4008515 0.89 MAPT (0.80) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4007152 0.84 MAPK1 (0.72) MAPTHTTMAPK1AHRPI4KB
SCHEMBL14026142 0.84 MAPK1 (0.72) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4935871 0.83 RAF1 (0.64) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4759186 0.82 MAPT (0.57) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4885395 0.81 MAPK1 (0.64) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4937677 0.81 SRC (0.57) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4886107 0.81 MAPT (0.67) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4013688 0.81 MAPK1 (0.67) MAPTHTTMAPK1AHRPI4KB
SCHEMBL4007243 0.80 CYP1A2 (0.67) MAPTHTTMAPK1AHRPI4KB

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-1991533-A1 CHEMICAL COMPOUNDS Arrow Therapeutics Limited (GB) 2008-11-19 EP disclosed
US-20080267914-A1 Chemical Compounds ASTRAZENECA AB (SE) 2008-10-30 US disclosed
WO-2007042782-A1 CHEMICAL COMPOUNDS ARROW THERAPEUTICS LIMITED (GB) 2007-04-19 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-20080267914-A1 Chemical Compounds RNASEL, ZC3HAV1L, RNASEH1 MAPT 4645/4885HTT 3635/4885MAPK1 1706/4885

“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.