SCHEMBL6730674

SCHEMBL6730674

O=C(O)C1(N2CCNCC2)CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.41
CHKA P35790 1/20 0.41
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
HCN1 O60741 1/20 0.33
HCN3 Q9P1Z3 1/20 0.33
HCN2 Q9UL51 1/20 0.33
HCN4 Q9Y3Q4 1/20 0.33
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
CHRNB3 Q05901 1/20 0.31
CHRNA6 Q15825 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM3 P20309 1/20 0.31
CYP1A2 P05177 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
Hydrochloric Acid SCHEMBL6732984 0.98 CA2 (0.39) CA2CHKACA12CA1CA9
SCHEMBL1900245 0.90 CA2 (0.37) CA2CHKACA12CA1CA9
Hydrochloric Acid SCHEMBL15194195 0.88 CA2 (0.35) CA2CHKACA12CA1CA9
SCHEMBL14858388 0.83 ALDH1A1 (0.40) CYP2C19SIGMAR1HSD11B1ALDH1A1TP53
SCHEMBL5200587 0.82 ALDH1A1 (0.42) CA2CHKACYP2C19KDM4EALDH1A1
Hydrochloric Acid SCHEMBL6503554 0.81 ALDH1A1 (0.41) CA2CHKACYP2C19KDM4EALDH1A1
SCHEMBL5332707 0.81 ALDH1A1 (0.38) CYP2C19SIGMAR1HSD11B1ALDH1A1TP53
SCHEMBL14061763 0.78 KDM1A (0.35) CYP2C19HSD11B1ALDH1A1TP53
SCHEMBL14434750 0.78 CA2 (0.36) CA2CHKAHCN1HCN3HCN2
SCHEMBL25435115 0.76 ALDH1A1 (0.38) ALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4709720-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN Larkspur Biosciences, Inc. (US) 2026-03-18 EP disclosed
WO-2024233846-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES, INC. (US) 2024-11-14 WO disclosed
US-20040192676-A1 Ligands of melanocortin receptors and compositions and methods related thereto NEUROCRINE BIOSCIENCES, INC. 2004-09-30 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-20040192676-A1 Ligands of melanocortin receptors and compositions and methods related thereto MC3R, MC1R, MC2R CA2 2537/4885CHKA 2873/4885CA12 3405/4885

“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.