SCHEMBL10175378

SCHEMBL10175378

CCN(CC)C[C@H]1CCCCO1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.36
PER2 O15055 1/20 0.33
CRY1 Q16526 1/20 0.33
CRY2 Q49AN0 1/20 0.33
KMT2A Q03164 3/20 0.33
GRIN1 Q05586 1/20 0.33
PKM P14618 1/20 0.33
PDE8B O95263 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
EPHX1 P07099 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL10175373 1.00 ALDH1A1 (0.42) ALDH1A1LMNAMAPTPER2CRY1
SCHEMBL21127002 0.94 ALDH1A1 (0.47) ALDH1A1LMNAMAPTKMT2APKM
SCHEMBL23969731 0.82 LMNA (0.47) ALDH1A1LMNAMAPTKMT2APKM
SCHEMBL10145306 0.78 LMNA (0.38) ALDH1A1LMNAPER2CRY1CRY2
SCHEMBL15865805 0.78 ALDH1A1 (0.53) ALDH1A1LMNAMAPTKMT2AGAA
SCHEMBL26243113 0.77 ALDH1A1 (0.42) ALDH1A1LMNAMAPTPER2CRY1
SCHEMBL81620 0.75 ALDH1A1 (0.39) ALDH1A1LMNAKMT2APKMPOLB
SCHEMBL22519832 0.75 KMT2A (0.36) ALDH1A1LMNAPER2CRY1CRY2
SCHEMBL23841443 0.75 ALDH1A1 (0.39) ALDH1A1LMNAKMT2APKMPOLB
SCHEMBL12236665 0.75 ALDH1A1 (0.39) ALDH1A1LMNAKMT2APKMPOLB

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-20160176906-A1 Chemical Compounds ASTRAZENECA AB (SE) 2016-06-23 US disclosed
US-9248140-B2 Chemical compounds ASTRAZENECA AB (SE) 2016-02-02 US disclosed
US-20150328239-A1 Chemical Compounds ASTRAZENECA AB (SE) 2015-11-19 US disclosed
US-9018381-B2 Chemical compounds ASTRAZENECA AB (SE) 2015-04-28 US disclosed
US-20130310344-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ASTRAZENECA AB (UK) 2013-11-21 US disclosed
US-20120035134-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-09 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 (4 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-20120035134-A1 CHEMICAL COMPOUNDS BCL2, BCL2L1, BAX ALDH1A1 1025/4885LMNA 2184/4885MAPT 3667/4885
US-20150328239-A1 Chemical Compounds BCL2, BCL2L1, BAX ALDH1A1 1025/4885LMNA 2184/4885MAPT 3667/4885
US-20160176906-A1 Chemical Compounds BCL2, BCL2L1, BAX ALDH1A1 1025/4885LMNA 2184/4885MAPT 3667/4885
US-20130310344-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BCL2, BAX, BCLAF1 ALDH1A1 2563/4885LMNA 547/4885MAPT 4833/4885

“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.