SCHEMBL14376090

SCHEMBL14376090

CCN1CCN(c2ccc(C)cn2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ DRD2 P14416 4/20 0.56
▸ DRD3 P35462 4/20 0.56
▸ DRD1 P21728 3/20 0.56
▸ DRD5 P21918 3/20 0.56
▸ DRD4 P21917 2/20 0.56
▸ HTR1A P08908 1/20 0.56
▸ HTR2A P28223 1/20 0.56
▸ HTR2C P28335 1/20 0.56
▸ SLC6A4 P31645 1/20 0.56
▸ HTR7 P34969 1/20 0.56
▸ DHFR P00374 1/20 0.53
▸ HRH3 Q9Y5N1 2/20 0.50
▸ GRIN2D O15399 1/20 0.49
▸ GRIN3B O60391 1/20 0.49
▸ GRIN1 Q05586 1/20 0.49
▸ GRIN2A Q12879 1/20 0.49
▸ GRIN2B Q13224 1/20 0.49
▸ GRIN2C Q14957 1/20 0.49

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
SCHEMBL21424864 0.87 GRIN2D (0.59) KDM4EGAADRD2DRD3DRD1
SCHEMBL15496957 0.87 DRD2 (0.60) KDM4EGAADRD2DRD3DRD1
SCHEMBL7620575 0.83 DRD2 (0.43) KDM4EGAADRD2DRD3DRD1
SCHEMBL12859199 0.82 DRD2 (0.59) GAADRD2DRD3DRD1DRD5
SCHEMBL25516250 0.82 DRD2 (0.52) KDM4EGAADRD2DRD3DRD1
SCHEMBL4010339 0.81 GAA (0.55) KDM4EGAAHRH3GRIN2DGRIN3B
SCHEMBL6927518 0.81 KDM4E (0.55) KDM4EGAADRD2DRD3DRD4
SCHEMBL6929102 0.81 KDM4E (0.55) KDM4EGAADRD2DRD3DRD1
SCHEMBL1682870 0.81 GAA (0.57) KDM4EGAADRD2DRD3DRD1
SCHEMBL18086473 0.81 DRD2 (0.54) KDM4EDRD2DRD3DRD1DRD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. 2023-10-12 — — US disclosed
WO-2023078813-A1 HETEROBIFUNCTIONAL MOLECULES AS TEAD INHIBITORS MERCK PATENT GMBH (DE) 2023-05-11 — — WO disclosed
WO-2017040450-A1 TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL-MYERS SQUIBB COMPANY (US) 2017-03-09 — — WO disclosed
US-7312209-B2 Acridone inhibitors of IMPDH enzyme BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-25 — — 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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR HMGCR, GCDH, CYP11A1 KDM4E 1116/4885GAA 101/4885DRD2 4873/4885

“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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