SCHEMBL7475559

SCHEMBL7475559

CC(C)(C)C1CCN(CCCN)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CYP2D6 P10635 2/20 0.45
ALOX15 P16050 2/20 0.45
CYP1A2 P05177 1/20 0.45
GNAI3 P08754 2/20 0.39
GNAO1 P09471 2/20 0.39
GNAI1 P63096 2/20 0.39
SIGMAR1 Q99720 3/20 0.37
HSD17B10 Q99714 1/20 0.36
CYP2J2 P51589 1/20 0.35
CHRM1 P11229 1/20 0.35

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
SCHEMBL12062280 0.89 KEAP1 (0.38) KEAP1SMN1; SMN2CYP2D6ALOX15CYP1A2
SCHEMBL3318265 0.88 ALOX15 (0.50) CYP2D6ALOX15CYP1A2GNAI3GNAO1
SCHEMBL12062271 0.83 GNAI3 (0.36) KEAP1SMN1; SMN2CYP2D6ALOX15CYP1A2
SCHEMBL13602676 0.82 CYP1A2 (0.47) CYP2D6ALOX15CYP1A2GNAI3GNAO1
SCHEMBL17282197 0.82 CYP1A2 (0.50) SMN1; SMN2CYP2D6ALOX15CYP1A2SIGMAR1
SCHEMBL14199998 0.82 GNAO1 (0.48) CYP2D6ALOX15CYP1A2GNAI3GNAO1
SCHEMBL2209216 0.80 KEAP1 (0.45) KEAP1SMN1; SMN2CYP2D6ALOX15GNAI3
SCHEMBL19959037 0.80 CYP1A2 (0.45) CYP2D6ALOX15CYP1A2GNAI3GNAO1
SCHEMBL9038080 0.80 CYP1A2 (0.45) SMN1; SMN2CYP2D6ALOX15CYP1A2GNAI3
SCHEMBL26748937 0.80 GNAO1 (0.56) CYP2D6ALOX15CYP1A2GNAI3GNAO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023104155-A1 LIGAND COMPOUNDS FOR E3 UBIQUITIN LIGASE, PROTEIN DEGRADERS DEVELOPED ON BASIS OF LIGAND COMPOUNDS, AND USES THEREOF 标新生物医药科技(上海)有限公司 2023-06-15 WO disclosed
US-10654828-B2 Indole derivatives and uses thereof NOVARTIS AG (CH) 2020-05-19 US disclosed
US-20190055219-A1 INDOLE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2019-02-21 US disclosed
EP-1202738-A4 DIHYDROPYRAZINE DERIVATIVES AS NPY ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2002-08-14 EP disclosed
EP-1202738-A1 DIHYDROPYRAZINE DERIVATIVES AS NPY ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-05-08 EP disclosed
US-6177429-B1 SELECTIVE NEUROPEPTIDE Y (NPY) RECEPTOR ANTAGONISTS FOR PROMOTING WEIGHT LOSS AND TREATMENT OF EATING DISORDERS; ANOREXIGENIC AGENTS BRISTOL-MYERS SQUIBB COMPANY 2001-01-23 US disclosed
WO-2000078319-A1 DIHYDROPYRAZINE DERIVATIVES AS NPY ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-12-28 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-20190055219-A1 INDOLE DERIVATIVES AND USES THEREOF MYLK2, MYOF, MUSK KEAP1 1112/4885SMN1; SMN2 29/4885CYP2D6 4684/4885
US-10654828-B2 Indole derivatives and uses thereof MYLK2, MYOF, MUSK KEAP1 1112/4885SMN1; SMN2 29/4885CYP2D6 4684/4885

“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.