SCHEMBL5146469

SCHEMBL5146469

FC(F)Oc1ccc(C2CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.47
MAT2A P31153 4/20 0.41
DRD1 P21728 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
HSP90AA1 P07900 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
CCR6 P51684 1/20 0.40
ATM Q13315 1/20 0.40
ALOX15 P16050 1/20 0.40
GFER P55789 1/20 0.40
ADAM17 P78536 1/20 0.40
TSHR P16473 2/20 0.40
MDM2 Q00987 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 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
SCHEMBL8452616 0.92 NPC1 (0.46) IDO1MAT2AKMT2AMEN1ALDH1A1
SCHEMBL5147786 0.92 ALDH1A1 (0.44) IDO1DRD1KMT2AMEN1ALDH1A1
SCHEMBL5144864 0.92 DRD1 (0.43) IDO1DRD1KMT2AMEN1ALDH1A1
SCHEMBL14924284 0.91 ESR2 (0.52) IDO1MAT2ADRD1KMT2AMEN1
SCHEMBL5144846 0.90 KCNH2 (0.44) IDO1KMT2AALDH1A1LMNAHTT
SCHEMBL8766989 0.89 IDO1 (0.42) IDO1MAT2AKMT2AMEN1ALDH1A1
SCHEMBL4063657 0.88 IDO1 (0.41) IDO1MAT2ADRD1KMT2AMEN1
SCHEMBL13906289 0.88 IDO1 (0.41) IDO1MAT2ADRD1KMT2AMEN1
SCHEMBL13906463 0.88 IDO1 (0.41) IDO1MAT2ADRD1KMT2AMEN1
SCHEMBL9185418 0.86 IDO1 (0.40) IDO1MAT2ADRD1KMT2AMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018165520-A1 METALLOENZYME INHIBITOR COMPOUNDS VPS-3, INC. (US) 2018-09-13 WO disclosed
US-20070299072-A1 KV1.5 POTASSIUM CHANNEL INHIBITORS WYETH (US) 2007-12-27 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-20070299072-A1 KV1.5 POTASSIUM CHANNEL INHIBITORS KCNA5, KCNH1, KCNK5 IDO1 2069/4885MAT2A 4420/4885DRD1 1811/4885

“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.