SCHEMBL5354288

SCHEMBL5354288

Cc1cccc(C(=O)C=CN2CCC(C(O)CN3CCC(c4cc[nH]n4)CC3)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 11/20 0.42
DRD2 P14416 7/20 0.42
DRD3 P35462 3/20 0.39
MAPT P10636 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.35
UBE2M P61081 1/20 0.35
DCUN1D1 Q96GG9 1/20 0.35
GPR52 Q9Y2T5 1/20 0.35
SLC18A3 Q16572 1/20 0.35
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL5350047 0.85 PLD1 (0.33) DRD2MAPTLMNASLC18A3NPC1
SCHEMBL5358734 0.84 CHRM2 (0.32) DRD2SMN1; SMN2SLC18A3
SCHEMBL5327777 0.83 DRD2 (0.45) DRD4DRD2DRD3MAPTSLC18A3
SCHEMBL5350032 0.82 CCR2 (0.49) DRD2KMT2A
SCHEMBL5349560 0.81 NPSR1 (0.51) MAPTSMN1; SMN2LMNATP53
SCHEMBL5365348 0.80 CCR2 (0.46) DRD4DRD2
SCHEMBL14387009 0.79 NPC1 (0.42) RAB9ASMN1; SMN2LMNANPC1TP53
SCHEMBL5354293 0.79 NPC1 (0.42) RAB9ASMN1; SMN2LMNANPC1TP53
SCHEMBL5356626 0.74 DRD2 (0.43) DRD4DRD2DRD3MAPTRAB9A
SCHEMBL5360848 0.73 SLC18A3 (0.40) DRD4DRD2DRD3SLC18A3

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
WO-2007130712-A1 SUBSTITUTED DIPIPERIDINE AS CCR2 ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES JANSSEN PHARMACEUTICA, NV (BE) 2007-11-15 WO claimed
US-20070197590-A1 SUBSTITUTED DIPIPERIDINE CCR2 ANTAGONISTS JANSSEN PHARMACEUTCA N.V. (BE) 2007-08-23 US claimed
WO-2007130712-A1 SUBSTITUTED DIPIPERIDINE AS CCR2 ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES JANSSEN PHARMACEUTICA, NV (BE) 2007-11-15 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-20070197590-A1 SUBSTITUTED DIPIPERIDINE CCR2 ANTAGONISTS CCR2, CCR1, CCR5 DRD4 615/4885DRD2 284/4885DRD3 483/4885

“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.