SCHEMBL3588150

SCHEMBL3588150

O=C(Nc1ccc(I)cc1)[C@H]1C[C@@H](O)CN1C(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.62
POLB P06746 2/20 0.58
KLKB1 P03952 4/20 0.52
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 1/20 0.46
CFD P00746 1/20 0.41
CCR1 P32246 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
SCHEMBL3834358 0.88 F10 (0.62) F10POLBKLKB1MEN1KMT2A
SCHEMBL3590288 0.88 F10 (0.62) F10POLBKLKB1MEN1KMT2A
SCHEMBL3833847 0.86 F10 (0.60) F10POLBKLKB1MEN1KMT2A
SCHEMBL3830778 0.85 F10 (0.59) F10POLBKLKB1MEN1KMT2A
SCHEMBL8272842 0.85 F10 (0.59) F10POLBKLKB1MEN1KMT2A
SCHEMBL13420218 0.85 KLKB1 (0.62) F10POLBKLKB1MEN1KMT2A
SCHEMBL3835351 0.84 F10 (0.58) F10POLBKLKB1MEN1KMT2A
SCHEMBL3833286 0.84 F10 (0.66) F10POLBKLKB1MEN1KMT2A
SCHEMBL13725901 0.84 F10 (0.58) F10POLBKLKB1MEN1KMT2A
SCHEMBL20446539 0.83 F10 (0.56) F10POLBKLKB1MEN1KMT2A

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
US-7732481-B2 Prolinylarylacetamides MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-06-08 US disclosed
US-20070185189-A1 Prolinylarylacetamides MERCK PATENT GMBH (DE) 2007-08-09 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-20070185189-A1 Prolinylarylacetamides F12, F11, F2 F10 5/4885POLB 3435/4885KLKB1 1086/4885

“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.