SCHEMBL25820276

SCHEMBL25820276

CN1CCC(N2CC(CF)C2)CC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.42
NCF1 P14598 1/20 0.40
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.33
ALOX15 P16050 1/20 0.33
L3MBTL3 Q96JM7 1/20 0.32
GAA P10253 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL12717742 0.81 KDM1A (0.43) KDM1ANCF1ALDH1A1L3MBTL1ALOX15
SCHEMBL25001502 0.79
SCHEMBL24204754 0.78 KDM1A (0.41) KDM1ANCF1ALDH1A1L3MBTL1ALOX15
SCHEMBL24828028 0.78 KDM1A (0.41) KDM1ANCF1ALDH1A1L3MBTL1ALOX15
SCHEMBL22737333 0.78 KDM1A (0.41) KDM1ANCF1ALDH1A1L3MBTL1ALOX15
SCHEMBL15038030 0.77
SCHEMBL25922263 0.77 KDM4E (0.35) ALDH1A1ALOX15
SCHEMBL25921507 0.77 KDM4E (0.35) ALDH1A1ALOX15
SCHEMBL25921506 0.77 KDM4E (0.35) ALDH1A1ALOX15
SCHEMBL22695351 0.76 KDM1A (0.40) KDM1ANCF1ALDH1A1L3MBTL1ALOX15

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-20230219986-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR QILU PHARMACEUTICAL CO., LTD. (CN) 2023-07-13 US disclosed
US-20230219986-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR QILU PHARMACEUTICAL CO., LTD. (CN) 2023-07-13 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-20230219986-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR EGFR, ERBB2, ERBB4 KDM1A 2608/4885NCF1 1273/4885ALDH1A1 2690/4885

“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.