SCHEMBL6043619

SCHEMBL6043619

CCCCOC1CCN(C=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.35
LIPC P11150 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
EPHX2 P34913 1/20 0.33
TSHR P16473 4/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 3/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 2/20 0.30
USP2 O75604 1/20 0.30
POLB P06746 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL6043997 0.89 NPC1 (0.33) NPC1
SCHEMBL6044711 0.84 NPC1 (0.31) CYP3A4NPC1
SCHEMBL20376444 0.81 TAAR1 (0.36) SMN1; SMN2LIPCLIPGNPC1POLB
SCHEMBL3496965 0.81 CHRM4 (0.31) SMN1; SMN2ALDH1A1
SCHEMBL23842051 0.79 LSS (0.31)
SCHEMBL6603236 0.77 GNAI3 (0.43) SMN1; SMN2LIPCLIPGHPGDNPC1
SCHEMBL6603242 0.77 GNAI3 (0.43) SMN1; SMN2LIPCLIPGHPGDNPC1
SCHEMBL10372775 0.76 GBA1 (0.36) EPHX2TSHRCYP3A4HPGDALDH1A1
SCHEMBL22856184 0.76 GNAI3 (0.40) SMN1; SMN2TSHRNPC1
SCHEMBL5986706 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018098206-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 WO disclosed
US-20060089355-A1 Methods of treating alzheimer's disease using aromatically substituted w-amino-alkanoic acid amides and alkanoic acid diamides ELAN PHARMACEUTICALS, INC. 2006-04-27 US disclosed
WO-2003103652-A1 METHODS OF TREATING ALZHEIMER’S DISEASE USING AROMATICALLY SUBSTITUTED ω-AMINO-ALKANOIC ACID AMIDES AND ALKANOIC ACID DIAMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed
US-5641778-A EXHIBIT RENIN-INHIBITING PROPERTIES AND CAN BE USED AS ANTIHYPERTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-06-24 US disclosed
EP-0716077-A1 Aromatically substituted omega amino alcanoic acid amides and alcanoic diamides and their use as renine inhibitors CIBA-GEIGY AG (CH) 1996-06-12 EP 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-20060089355-A1 Methods of treating alzheimer's disease using aromatically substituted w-amino-alkanoic acid amides and alkanoic acid diamides APP, BACE1, BACE2 SMN1; SMN2 1043/4885LIPC 1332/4885LIPG 1947/4885

“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.