SCHEMBL4064579

SCHEMBL4064579

CN(Cc1ccccc1)C(=O)[CH]Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
CA12 O43570 2/20 0.58
CA9 Q16790 2/20 0.58
KMT2A Q03164 4/20 0.53
MEN1 O00255 2/20 0.51
MGLL Q99685 1/20 0.51
HPGD P15428 2/20 0.50
RIPK1 Q13546 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 2/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
POLB P06746 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
SCHEMBL27822290 0.92 MTOR (0.55) NPC1RAB9ACA12CA9KMT2A
SCHEMBL4068051 0.85 LMNA (0.55) NPC1RAB9ACA12CA9KMT2A
SCHEMBL24592166 0.84 NPC1 (0.59) NPC1RAB9ACA12CA9KMT2A
SCHEMBL27841533 0.83 NPC1 (0.44) NPC1RAB9ACA12CA9KMT2A
SCHEMBL3163930 0.81 NPC1 (0.61) NPC1RAB9ACA12CA9KMT2A
SCHEMBL14562610 0.81 NPC1 (0.61) NPC1RAB9ACA12CA9KMT2A
SCHEMBL491378 0.80 NPC1 (0.65) NPC1RAB9ACA12CA9KMT2A
SCHEMBL4017346 0.80 NPC1 (0.65) NPC1RAB9ACA12CA9KMT2A
SCHEMBL4206585 0.79 NPC1 (0.58) NPC1RAB9ACA12CA9KMT2A
SCHEMBL10181786 0.79 NPC1 (0.58) NPC1RAB9ACA12CA9KMT2A

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
EP-1415986-B1 SPIRO ISOBENZOFURANES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS BANYU PHARMA CO LTD (JP) 2009-04-08 EP disclosed
US-7205417-B2 Spiro compounds BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-04-17 US disclosed
US-20040259890-A1 Spiro compounds MSD K.K. (JP) 2004-12-23 US disclosed
EP-1415986-A1 SPIRO COMPOUNDS BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP 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-20040259890-A1 Spiro compounds OPRD1, PER2, OPRK1 NPC1 1009/4885RAB9A 1702/4885CA12 4083/4885

“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.