SCHEMBL3771970

SCHEMBL3771970

O=C(Nc1cccnc1)N1CCN(c2nc(-c3cccc(Cl)c3)cs2)CC1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.63
ALDH1A1 P00352 7/20 0.63
MAPK1 P28482 5/20 0.63
LMNA P02545 4/20 0.63
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
GAA P10253 2/20 0.63
NPSR1 Q6W5P4 1/20 0.63
SMN1; SMN2 Q16637 4/20 0.58
HTT P42858 4/20 0.58
TP53 P04637 3/20 0.58
FAAH O00519 5/20 0.57
ALOX12 P18054 1/20 0.55
RAB9A P51151 1/20 0.55
GLA P06280 1/20 0.54
RECQL P46063 1/20 0.51
HSD17B10 Q99714 1/20 0.51
ROCK1 Q13464 1/20 0.51
POLB P06746 1/20 0.48

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
SCHEMBL3765698 0.89 MAPT (0.64) MAPTALDH1A1MAPK1LMNAMEN1
SCHEMBL3761029 0.89 FAAH (0.63) MAPTALDH1A1MAPK1LMNAMEN1
SCHEMBL3761168 0.88 FAAH (0.68) MAPTALDH1A1MAPK1LMNAMEN1
Hydrochloric Acid SCHEMBL3772523 0.88 FAAH (0.67) MAPTALDH1A1MAPK1LMNAMEN1
SCHEMBL3766404 0.86 MAPT (0.59) MAPTALDH1A1MAPK1LMNAMEN1
SCHEMBL3770874 0.86 MAPT (0.83) MAPTALDH1A1MAPK1LMNAMEN1
SCHEMBL3766412 0.86 MAPT (0.59) MAPTALDH1A1MAPK1LMNAMEN1
SCHEMBL3764586 0.86 MAPT (0.53) MAPTALDH1A1MAPK1LMNAMEN1
SCHEMBL3778524 0.84 SMN1; SMN2 (0.61) MAPTALDH1A1MAPK1LMNAGAA
SCHEMBL3766057 0.83 FAAH (0.52) MAPTALDH1A1MAPK1LMNAMEN1

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
US-7851473-B2 Amide compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-14 US disclosed
US-20080312226-A1 Amide Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-18 US disclosed
EP-1813606-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-08-01 EP 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-20080312226-A1 Amide Compound FAAH, FAAH2, CNR2 MAPT 3805/4885ALDH1A1 353/4885MAPK1 2636/4885

“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.