SCHEMBL17167482

SCHEMBL17167482

Cc1ccccc1N(CCC1CCCCN1C(=O)OC(C)(C)C)C1Cc2ccccc2C1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.45
AHCY P23526 3/20 0.44
ATM Q13315 2/20 0.43
OPRD1 P41143 1/20 0.43
TP53 P04637 1/20 0.41
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CHEK2 O96017 1/20 0.37
METTL3 Q86U44 1/20 0.37
LMNA P02545 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PRMT5 O14744 3/20 0.36
PDE8B O95263 1/20 0.36
UCHL1 P09936 1/20 0.36
WDR77 Q9BQA1 2/20 0.35
DRD2 P14416 1/20 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
SCHEMBL11990571 1.00 KDM1A (0.45) KDM1AAHCYATMOPRD1TP53
SCHEMBL11969463 0.86 KDM1A (0.46) KDM1AAHCYATMOPRD1MEN1
SCHEMBL11990569 0.84 OPRD1 (0.47) KDM1AAHCYATMOPRD1MEN1
SCHEMBL11969416 0.83 KDM1A (0.44) KDM1AAHCYATMOPRD1MEN1
SCHEMBL11990468 0.80 CHRM1 (0.44) TP53
SCHEMBL20012621 0.80 CHRM1 (0.44) TP53
SCHEMBL11990470 0.77 LMNA (0.34) TP53LMNADRD2
SCHEMBL17167149 0.77 LMNA (0.34) TP53LMNADRD2
SCHEMBL11969924 0.77 KDM1A (0.55) KDM1AAHCYATMOPRD1MEN1
SCHEMBL11969272 0.74 OPRD1 (0.52) KDM1AAHCYATMOPRD1MEN1

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-20150290182-A1 USE OF AMINOINDANE COMPOUNDS IN TREATING OVERACTIVE BLADDER AND INTERSTITIAL CYSTITIS ASANA BIOSCIENCES, LLC (US) 2015-10-15 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-20150290182-A1 USE OF AMINOINDANE COMPOUNDS IN TREATING OVERACTIVE BLADDER AND INTERSTITIAL CYSTITIS IDO1, IDO2, SLC1A2 KDM1A 2847/4885AHCY 320/4885ATM 2452/4885

“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.