SCHEMBL18024075

SCHEMBL18024075

CCN(C)CCN1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CXCR4 P61073 2/20 0.39
SIGMAR1 Q99720 10/20 0.37
HSD17B10 Q99714 1/20 0.36
RAD52 P43351 1/20 0.34
PHGDH O43175 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
SCHEMBL21848373 0.89 ALDH1A1 (0.45) ALDH1A1MAPTPOLBSMN1; SMN2CXCR4
SCHEMBL11922705 0.88 CXCR4 (0.46) ALDH1A1MAPTPOLBSMN1; SMN2CXCR4
SCHEMBL21120551 0.86 SIGMAR1 (0.42) ALDH1A1MAPTPOLBSMN1; SMN2CXCR4
SCHEMBL20750292 0.84
SCHEMBL21348400 0.82 SIGMAR1 (0.47) ALDH1A1MAPTPOLBSMN1; SMN2CXCR4
SCHEMBL18427338 0.82 CA12 (0.44) ALDH1A1MAPTPOLBSMN1; SMN2CXCR4
SCHEMBL151633 0.81 POLB (0.42) ALDH1A1MAPTPOLBSMN1; SMN2CXCR4
SCHEMBL7003575 0.80 SIGMAR1 (0.50) SIGMAR1
SCHEMBL19493355 0.80 SIGMAR1 (0.46) SIGMAR1
SCHEMBL2912801 0.80 ALDH1A1 (0.45) ALDH1A1MAPTPOLBSMN1; SMN2CXCR4

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-20230399303-A1 Macrophage Migration Inhibitory Factor Inhibitors, and Methods of Making and Using Same UNIV YALE (US) 2023-12-14 US disclosed
WO-2022093817-A1 MACROPHAGE MIGRATION INHIBITORY FACTOR INHIBITORS, AND METHODS OF MAKING AND USING SAME YALE UNIVERSITY (US) 2022-05-05 WO disclosed
US-10968198-B2 Biaryltriazole inhibitors of macrophage migration inhibitory factor YALE UNIVERSITY (US) 2021-04-06 US disclosed
EP-3267794-B1 BIARYLTRIAZOLE INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR UNIV YALE (US) 2020-09-09 EP disclosed
US-20190276425-A1 BIARYLTRIAZOLE INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR UNIV YALE (US) 2019-09-12 US disclosed
WO-2016130968-A1 BIARYLTRIAZOLE INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR YALE UNIVERSITY (US) 2016-08-18 WO 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 (3 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-10968198-B2 Biaryltriazole inhibitors of macrophage migration inhibitory factor MIF, MMP12, CSF1R ALDH1A1 3264/4885MAPT 4521/4885POLB 3658/4885
US-20190276425-A1 BIARYLTRIAZOLE INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR MIF, MMP12, CSF1R ALDH1A1 3264/4885MAPT 4521/4885POLB 3658/4885
US-20230399303-A1 Macrophage Migration Inhibitory Factor Inhibitors, and Methods of Making and Using Same MIF, MMP12, METAP1 ALDH1A1 2264/4885MAPT 371/4885POLB 3295/4885

“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.