SCHEMBL6907464

SCHEMBL6907464

CCCC(O)C1CCCCCCC1=O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.46
KMT2A Q03164 1/20 0.41
CA1 P00915 3/20 0.38
CA2 P00918 2/20 0.38
CA4 P22748 2/20 0.38
ALDH1A1 P00352 6/20 0.35
POLB P06746 2/20 0.35
MAPT P10636 1/20 0.34
NPC1 O15118 2/20 0.33
HPGD P15428 2/20 0.33
RAB9A P51151 2/20 0.33
CA6 P23280 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ACE P12821 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL7063108 1.00 CYP2D6 (0.46) CYP2D6KMT2ACA1CA2CA4
SCHEMBL1237574 0.98 CYP2D6 (0.47) CYP2D6KMT2ACA1CA2CA4
SCHEMBL1237594 0.93 CYP2D6 (0.41) CYP2D6KMT2ACA1CA2CA4
SCHEMBL1238048 0.88 CYP2D6 (0.44) CYP2D6KMT2ACA1CA2CA4
SCHEMBL1238202 0.87 CYP2D6 (0.43) CYP2D6
SCHEMBL7936556 0.86 CYP2D6 (0.48) CYP2D6KMT2ACA1CA2CA4
SCHEMBL11903954 0.85 CYP2D6 (0.43) CYP2D6
SCHEMBL1238055 0.84 CYP2D6 (0.49) CYP2D6KMT2ACA1CA2CA4
SCHEMBL913008 0.83 CYP2D6 (0.39) CYP2D6MAPT
SCHEMBL1238426 0.81 CYP2D6 (0.38) CYP2D6

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-20040091515-A1 Noxious-insect repellent KANEBO, LTD. 2004-05-13 US disclosed
US-6686396-B2 NO OFFENSIVE ODOR AND EXHIBIT EXCELLENT NOXIOUS-INSECT REPELLING EFFECT AND DURABILITY KANEBO, LTD. (JP) 2004-02-03 US disclosed
US-6677384-B1 CARBOCYCLIC ALCOHOLS SUCH AS 2-HYDROXYMETHYL-3,3,5-TRIMETHYL-CYCLOHEXANOL USED AS ODORLESS, DURABLE LOTIONS TO PREVENT DISEASES KANEBO, LTD. (JP) 2004-01-13 US disclosed
US-20020143070-A1 Noxious-insect repellent KANEBO, LTD. 2002-10-03 US disclosed
US-6372804-B1 HYDROXYALKYLCYCLOALKANOLS REPELLENTS KANEBO, LTD. (JP) 2002-04-16 US disclosed
US-6130255-A EXPOSING NOXIOUS INSECTS TO REPELLENT COMPRISING 2-(1-HYDROXYALKYL)-CYCLOALKANOLS HAVING NO OFFENSIVE ODOR KAO CORPORATION (JP) 2000-10-10 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 (2 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-20020143070-A1 Noxious-insect repellent OPRM1, OPRD1, L3MBTL1 CYP2D6 1959/4885KMT2A 1676/4885CA1 4038/4885
US-20040091515-A1 Noxious-insect repellent OPRM1, OPRD1, OPRK1 CYP2D6 3047/4885KMT2A 2769/4885CA1 4042/4885

“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.