SCHEMBL17207233

SCHEMBL17207233

COc1c(C)cccc1C(=O)NCCF

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.55
SMN1; SMN2 Q16637 6/20 0.50
NPC1 O15118 5/20 0.50
RAB9A P51151 5/20 0.50
ALDH1A1 P00352 3/20 0.50
MAPT P10636 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MAPK1 P28482 2/20 0.50
LMNA P02545 1/20 0.50
ALOX15 P16050 1/20 0.50
HSD17B10 Q99714 1/20 0.50
POLB P06746 1/20 0.49
KMT2A Q03164 2/20 0.44
APEX1 P27695 3/20 0.44
NAMPT P43490 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43

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
SCHEMBL18930087 0.86 HPGD (0.56) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL17689161 0.86 HPGD (0.56) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL17194920 0.86 HPGD (0.64) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL17194900 0.84 HPGD (0.60) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL17689162 0.84 HPGD (0.77) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL17207245 0.83 LMNA (0.53) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL13162698 0.82 HPGD (0.62) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL17194895 0.81 HPGD (0.51) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL17194926 0.81 NAAA (0.59) HPGDSMN1; SMN2ALDH1A1L3MBTL1LMNA
SCHEMBL17194927 0.81 NPC1 (0.49) HPGDSMN1; SMN2NPC1RAB9AALDH1A1

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-2922841-B1 ALKYL-AMIDE-SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2017-06-07 EP disclosed
US-9315494-B2 Alkyl-amide-substituted pyridyl compounds useful as modulators of IL-12, IL-23 and/or IFNα responses BRISTOL-MYERS SQUIBB COMPANY (US) 2016-04-19 US disclosed
US-20150307483-A1 ALKYL-AMIDE-SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL-MYERS SQUIBB COMPANY 2015-10-29 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-20150307483-A1 ALKYL-AMIDE-SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES IFNG, TYK2, IFNAR1 HPGD 3058/4885SMN1; SMN2 3661/4885NPC1 4872/4885

“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.