SCHEMBL4172184

SCHEMBL4172184

COc1cccc(CCc2ccccc2OCCN2CCN(c3ccc(F)cc3)CC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 20/20 1.00
DRD2 P14416 3/20 0.68

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
SCHEMBL4176822 0.95 ABCB1 (1.00) ABCB1DRD2
SCHEMBL4182261 0.94 ABCB1 (1.00) ABCB1DRD2
SCHEMBL4181085 0.87 ABCB1 (1.00) ABCB1DRD2
SCHEMBL4183345 0.86 ABCB1 (1.00) ABCB1DRD2
SCHEMBL4186798 0.86 ABCB1 (1.00) ABCB1DRD2
SCHEMBL4179477 0.82 ABCB1 (1.00) ABCB1DRD2
SCHEMBL4186793 0.82 ABCB1 (1.00) ABCB1DRD2
SCHEMBL4180271 0.81 ABCB1 (1.00) ABCB1DRD2
SCHEMBL4189432 0.81 ABCB1 (1.00) ABCB1DRD2
SCHEMBL4168989 0.81 ABCB1 (1.00) ABCB1DRD2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090093493-A1 1-PHENYLALCOXY-2-BETA-PHENYLETHYL DERIVATIVES AS P-GLYCOPROTEIN (P-GP) INHIBITORS USEFUL IN DRUG RESISTANCE EVENTS UNIVERSITA DI PISA, 40% (IT) 2009-04-09 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-20090093493-A1 1-PHENYLALCOXY-2-BETA-PHENYLETHYL DERIVATIVES AS P-GLYCOPROTEIN (P-GP) INHIBITORS USEFUL IN DRUG RESISTANCE EVENTS ABCB1, ABCC1, ABCC2 ABCB1 1/4885DRD2 1431/4885

“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.