SCHEMBL7088263

SCHEMBL7088263

CCc1cc2cc(OC)c(Cl)cc2n1Cc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.44
IDO1 P14902 2/20 0.40
OPRK1 P41145 2/20 0.39
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
FAAH O00519 1/20 0.35
MAOB P27338 1/20 0.35
PYCR1 P32322 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
CCR2 P41597 4/20 0.35

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
SCHEMBL7592632 0.82 ABCB11 (0.41) ABCB11IDO1OPRK1MAPTLMNA
SCHEMBL7086760 0.81 ABCB11 (0.53) ABCB11MAPTLMNAHTTTSHR
SCHEMBL7597285 0.74 ABCB11 (0.45) ABCB11MAPTLMNAMEN1HTT
SCHEMBL7083180 0.74 ABCB11 (0.52) ABCB11MAPTLMNAHTTMAPK1
SCHEMBL7088272 0.74 NOD2 (0.47) ABCB11MAPTLMNAHTTTSHR
SCHEMBL16818957 0.69 DCTPP1 (0.44) MAPTLMNAMEN1HTTKMT2A
SCHEMBL7086771 0.68 ABCB11 (0.48) ABCB11MAPTLMNAMEN1HTT
SCHEMBL7083764 0.68 ABCB11 (0.57) ABCB11MAPTLMNAHTTTSHR
SCHEMBL257060 0.68 IDO1 (0.61) IDO1LMNAMAOBPYCR1
SCHEMBL7082918 0.67 CCR2 (0.55) ABCB11MAPTLMNAHTTMAPK1

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-20030144339-A1 Indole derivatives as mcp-1 receptor antagonists ASTRAZENECA AB (SE) 2003-07-31 US disclosed
EP-1252142-A1 INDOLE DERIVATIVES AS MCP-1 RECEPTOR ANTAGONISTS AstraZeneca AB (SE) 2002-10-30 EP disclosed
WO-2001051466-A1 INDOLE DERIVATIVES AS MCP-1 RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2001-07-19 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-20030144339-A1 Indole derivatives as mcp-1 receptor antagonists CCR2, CCR1, CCR5 ABCB11 391/4885IDO1 41/4885OPRK1 51/4885

“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.