SCHEMBL7513632

SCHEMBL7513632

CCCN(CCC)CCCCNCCCN

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.54
CA12 O43570 2/20 0.54
F13A1 P00488 2/20 0.54
CA2 P00918 2/20 0.54
CYP1A2 P05177 2/20 0.54
CA4 P22748 2/20 0.54
CA6 P23280 2/20 0.54
CA5A P35218 2/20 0.54
THPO P40225 2/20 0.54
CA7 P43166 2/20 0.54
CA9 Q16790 2/20 0.54
CA14 Q9ULX7 2/20 0.54
CA5B Q9Y2D0 2/20 0.54
CASP2 P42575 2/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
CYP2C19 P33261 1/20 0.54
RECQL P46063 1/20 0.54
HSD17B10 Q99714 1/20 0.54
TSHR P16473 3/20 0.52

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
SCHEMBL6707213 0.96 TDP1 (0.57) ALOX15CA12F13A1CA2CYP1A2
SCHEMBL324827 0.96 ALOX15 (0.52) ALOX15CA12F13A1CA2CYP1A2
SCHEMBL323341 0.94 CA12 (0.50) ALOX15CA12F13A1CA2CYP1A2
SCHEMBL324690 0.94 CA12 (0.50) ALOX15CA12F13A1CA2CYP1A2
SCHEMBL323046 0.94 TDP1 (0.59) ALOX15CA12F13A1CA2CYP1A2
SCHEMBL7170238 0.92 TSHR (0.54) ALOX15CA12F13A1CA2CYP1A2
SCHEMBL7513624 0.92 CA12 (0.52) ALOX15CA12F13A1CA2CYP1A2
SCHEMBL20675950 0.90 ALOX15 (0.43) ALOX15CA12F13A1CA2CYP1A2
SCHEMBL11209433 0.89 TDP1 (0.54) ALOX15CA12F13A1CA2CYP1A2
SCHEMBL757198 0.89 TSHR (0.52) CYP1A2MEN1KMT2ACYP2C19TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020045780-A1 Biologically active spermidine analogues, pharmaceutical compositions and methods of treatment BERGERON RAYMOND J (US) 2002-04-18 US disclosed
US-6235794-B1 ANTICANCER AGENT UNIVERSITY OF FLORIDA 2001-05-22 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-20020045780-A1 Biologically active spermidine analogues, pharmaceutical compositions and methods of treatment SRM, SLC7A1, CATSPER1 ALOX15 4427/4885CA12 3973/4885F13A1 2954/4885

“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.