SCHEMBL4729797

SCHEMBL4729797

COc1cccc(/C(=N\O)Nc2ccc(F)c(Cl)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.55
NPC1 O15118 7/20 0.55
RAB9A P51151 7/20 0.55
SMN1; SMN2 Q16637 5/20 0.55
HTT P42858 2/20 0.55
MEN1 O00255 6/20 0.55
KMT2A Q03164 6/20 0.55
MCL1 Q07820 1/20 0.53
CASP3 P42574 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
POLB P06746 2/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 2/20 0.47

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
SCHEMBL4729799 1.00 MAPT (0.55) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL4726650 0.86 NPC1 (0.54) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL4726649 0.86 NPC1 (0.54) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL4730873 0.85 MAPT (0.67) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL4730870 0.85 MAPT (0.67) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL14214470 0.85 MAPT (0.55) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL4729800 0.78 IDO1 (0.55) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL21390010 0.77 MAPT (0.53) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL5630153 0.76 MAPT (0.44) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL5632051 0.76 MAPT (0.44) MAPTNPC1RAB9ASMN1; SMN2HTT

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-20080119491-A1 AMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2008-05-22 US claimed
WO-2008036643-A2 AMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2008-03-27 WO claimed
US-20080119491-A1 AMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2008-05-22 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-20080119491-A1 AMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, INMT MAPT 2706/4885NPC1 2658/4885RAB9A 3335/4885

“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.