SCHEMBL4240927

SCHEMBL4240927

CC(C)CN1CCC(O)(c2ccc(C(=O)NC(C)(C)CO)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ATM Q13315 1/20 0.43
CCR1 P32246 5/20 0.41
DRD2 P14416 7/20 0.40
CYP2D6 P10635 2/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADRA1A P35348 1/20 0.39

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
SCHEMBL4233319 0.86 NPC1 (0.42) NPC1RAB9AATMCCR1DRD2
SCHEMBL4745106 0.79 CYP2D6 (0.47) DRD2CYP2D6MAPK1ALDH1A1CYP3A4
SCHEMBL12726887 0.72 OPRL1 (0.61) DRD2
SCHEMBL6023280 0.67 NPC1 (0.54) NPC1RAB9AATMALDH1A1
SCHEMBL706443 0.67 HDAC1 (0.58) NPC1RAB9AATMMAPK1
SCHEMBL10123127 0.67 RAB9A (0.54) NPC1RAB9AATMALDH1A1
SCHEMBL28360034 0.66 NPC1 (0.52) NPC1RAB9AATMCYP3A4
SCHEMBL4240834 0.66 OGG1 (0.53) NPC1RAB9AATMALDH1A1
SCHEMBL3750397 0.66 POLB (0.54) NPC1RAB9AATMALDH1A1
SCHEMBL3757683 0.66 NPC1 (0.52) NPC1RAB9AATMALDH1A1

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R NPC1 2338/4885RAB9A 2492/4885ATM 4406/4885

“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.