SCHEMBL11990409

SCHEMBL11990409

COC(=O)CC1CCCN1B(C)O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ POLB P06746 2/20 0.34
▸ HDAC8 Q9BY41 2/20 0.33
▸ HDAC6 Q9UBN7 2/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ FFAR1 O14842 1/20 0.32
▸ FAP Q12884 4/20 0.32
▸ DPP4 P27487 3/20 0.32
▸ PREP P48147 2/20 0.32
▸ FHIT P49789 1/20 0.32
▸ OPRD1 P41143 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ DPP9 Q86TI2 1/20 0.31
▸ DPP7 Q9UHL4 1/20 0.31
▸ RAB9A P51151 1/20 0.31

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
SCHEMBL11990399 0.95 EPHX2 (0.33) L3MBTL1BRD4SMN1; SMN2FHIT
SCHEMBL11990444 0.95 EPHX2 (0.33) L3MBTL1BRD4SMN1; SMN2FHIT
SCHEMBL11990384 0.90 BRD4 (0.35) L3MBTL1POLBBRD4SMN1; SMN2FHIT
SCHEMBL25970252 0.81 L3MBTL1 (0.35) L3MBTL1POLBFAPDPP4PREP
SCHEMBL4088779 0.76 CHRNB2 (0.44) BRD4
SCHEMBL4088784 0.76 CHRNB2 (0.44) BRD4
SCHEMBL29108917 0.75 CHRM3 (0.43) L3MBTL1POLBHDAC8HDAC6BRD4
SCHEMBL26207994 0.75 CHRM3 (0.43) L3MBTL1POLBHDAC8HDAC6BRD4
SCHEMBL11990393 0.75 DPP4 (0.33) L3MBTL1POLBFAPDPP4DPP8
Hydrochloric Acid SCHEMBL21801537 0.75 CHRNB2 (0.43) BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9375423-B2 Use of aminoindane compounds in treating overactive bladder and interstitial cystitis ASANA BIOSCIENCES, LLC (US) 2016-06-28 — — US disclosed
US-20150290182-A1 USE OF AMINOINDANE COMPOUNDS IN TREATING OVERACTIVE BLADDER AND INTERSTITIAL CYSTITIS ASANA BIOSCIENCES, LLC (US) 2015-10-15 — — US disclosed
US-9044482-B2 Use of aminoindane compounds in treating overactive bladder and interstitial cystitis ASANA BIOSCIENCES, LLC (US) 2015-06-02 — — US disclosed
US-8865741-B2 Aminoindane compounds and use thereof in treating pain ASANA BIOSCIENCES, LLC (US) 2014-10-21 — — US disclosed
US-20140051702-A1 Use of Aminoindane Compounds in Treating Overactive Bladder and Interstitial Cystitis ENDO PHARMACEUTICALS INC. (US) 2014-02-20 — — US disclosed
US-20120214809-A1 Aminoindane Compounds and Use Thereof in Treating Pain Libertas Bio, Inc. 2012-08-23 — — 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 (3 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-20120214809-A1 Aminoindane Compounds and Use Thereof in Treating Pain TRPA1, TRPV1, TRPV2 L3MBTL1 2343/4885POLB 4837/4885HDAC8 2333/4885
US-20140051702-A1 Use of Aminoindane Compounds in Treating Overactive Bladder and Interstitial Cystitis IDO1, IDO2, SLC1A2 L3MBTL1 4836/4885POLB 2658/4885HDAC8 2309/4885
US-20150290182-A1 USE OF AMINOINDANE COMPOUNDS IN TREATING OVERACTIVE BLADDER AND INTERSTITIAL CYSTITIS IDO1, IDO2, SLC1A2 L3MBTL1 4836/4885POLB 2658/4885HDAC8 2309/4885

“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.

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