SCHEMBL4730873

SCHEMBL4730873

COc1ccc(C(=NO)Nc2ccc(F)c(Cl)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.67
HTT P42858 3/20 0.67
NPC1 O15118 3/20 0.67
RAB9A P51151 3/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
MEN1 O00255 7/20 0.58
KMT2A Q03164 7/20 0.58
CASP3 P42574 1/20 0.58
SENP7 Q9BQF6 1/20 0.58
ALDH1A1 P00352 2/20 0.57
APP P05067 1/20 0.52
TAS1R3 Q7RTX0 1/20 0.49
TAS1R1 Q7RTX1 1/20 0.49
TAS1R2 Q8TE23 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HCRTR1 O43613 1/20 0.47
HCRTR2 O43614 1/20 0.47
TSHR P16473 1/20 0.47
LMNA P02545 1/20 0.46
ACP1 P24666 1/20 0.46

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
SCHEMBL4730870 1.00 MAPT (0.67) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL4729799 0.85 MAPT (0.55) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL4729797 0.85 MAPT (0.55) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL14214643 0.83 MAPT (0.67) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL2185082 0.79 MAPT (0.52) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL2185072 0.79 MAPT (0.52) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL4730330 0.79 NPC1 (0.57) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL4730328 0.79 NPC1 (0.57) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL4727691 0.79 MEN1 (0.48) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4727694 0.79 MEN1 (0.48) MAPTNPC1RAB9ASMN1; SMN2MEN1

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 4 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
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 2706/4885HTT 612/4885NPC1 2658/4885

“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.