SCHEMBL21262265

SCHEMBL21262265

CN1CCCN(c2cc(C(=O)O)c(Cl)c(F)n2)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.45
▸ PKM P14618 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ USP2 O75604 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.44
▸ HRH4 Q9H3N8 5/20 0.43
▸ PIM1 P11309 1/20 0.40
▸ PIM2 Q9P1W9 1/20 0.40
▸ HTT P42858 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39
▸ PRKCQ Q04759 1/20 0.39

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
SCHEMBL21262268 0.91 PKM (0.44) KDM4EPKMMEN1USP2ALDH1A1
SCHEMBL21262194 0.88 PKM (0.44) KDM4EPKMMEN1ALDH1A1KMT2A
SCHEMBL21246754 0.79 HRH4 (0.54) KDM4EPKMHSD17B10HRH4HRH3
SCHEMBL21262254 0.74 FPR2 (0.39) KDM4EPKMMEN1USP2ALDH1A1
SCHEMBL21262258 0.72 HTR3A (0.50) KDM4EPKMALDH1A1HSD17B10HRH4
SCHEMBL5205003 0.71 PRKCQ (0.46) KDM4EPKMALDH1A1HSD17B10HRH4
SCHEMBL28455263 0.71 KDM4E (0.75) KDM4EPKMMEN1USP2ALDH1A1
SCHEMBL14558281 0.70 WNT1 (0.49) KDM4EPKMMEN1USP2ALDH1A1
Hydrochloric Acid SCHEMBL5343724 0.69 WNT1 (0.48) KDM4EPKMMEN1USP2ALDH1A1
SCHEMBL1774506 0.69 HRH4 (0.71) KMT2AHRH4HRH3

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
US-11518764-B2 Substituted heteroaryls as inhibitors of the BCL6 BTB domain protein-protein interaction ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-12-06 — — US disclosed
US-20200331921-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2020-10-22 — — US disclosed
WO-2019153080-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2019-08-15 — — 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 (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-11518764-B2 Substituted heteroaryls as inhibitors of the BCL6 BTB domain protein-protein interaction BCL6, BCL6B, BCL3 KDM4E 274/4885PKM 2887/4885MEN1 2263/4885
US-20200331921-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF BCL6, BCL6B, BCL3 KDM4E 364/4885PKM 2818/4885MEN1 2117/4885

“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.

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