SCHEMBL4780733

SCHEMBL4780733

O/N=C(/Nc1ccc(F)c(Cl)c1)c1cocn1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.47
KMT2A Q03164 7/20 0.47
MAPT P10636 3/20 0.47
HTT P42858 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 6/20 0.44
SLC2A1 P11166 1/20 0.43
LMNA P02545 3/20 0.43
TSHR P16473 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CASP3 P42574 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
FABP4 P15090 1/20 0.40

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
SCHEMBL4780736 1.00 MEN1 (0.47) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL4781928 0.84 SMN1; SMN2 (0.59) MEN1KMT2AMAPTNPSR1SMN1; SMN2
SCHEMBL14169206 0.83 MEN1 (0.48) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL4728379 0.78 MEN1 (0.51) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL4728377 0.78 MEN1 (0.51) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL14164036 0.77 SMN1; SMN2 (0.48) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL2190710 0.76 L3MBTL1 (0.62) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL4783316 0.76 KMT2A (0.47) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL4783320 0.76 KMT2A (0.47) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL2190712 0.76 L3MBTL1 (0.62) MEN1KMT2AMAPTHTTNPSR1

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-20080146624-A1 AMIDINES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2008-06-19 US claimed
WO-2008036652-A2 AMIDINES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2008-03-27 WO claimed
US-20080146624-A1 AMIDINES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2008-06-19 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-20080146624-A1 AMIDINES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, INMT MEN1 1795/4885KMT2A 636/4885MAPT 2180/4885

“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.