SCHEMBL2985198

SCHEMBL2985198

CC1(C(N)=O)CCCC2(C)c3ccccc3CCC12

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.67
▸ CYP3A4 P08684 1/20 0.67
▸ NR1H2 P55055 12/20 0.64
▸ NR1H3 Q13133 12/20 0.64
▸ POLA1 P09884 2/20 0.54
▸ SOD1 P00441 1/20 0.53
▸ RXRA P19793 1/20 0.53
▸ CCNE1 P24864 1/20 0.53
▸ CDK2 P24941 1/20 0.53
▸ RXRB P28702 1/20 0.53
▸ RXRG P48443 1/20 0.53
▸ KARS1 Q15046 1/20 0.53
▸ POLB P06746 1/20 0.52
▸ APEX1 P27695 1/20 0.52
▸ PDE4D Q08499 1/20 0.52

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
SCHEMBL6391596 1.00 LMNA (0.67) LMNACYP3A4NR1H2NR1H3POLA1
SCHEMBL20359348 0.88 POLA1 (0.68) NR1H2NR1H3POLA1RXRACCNE1
SCHEMBL31181392 0.88 POLA1 (0.68) NR1H2NR1H3POLA1RXRACCNE1
SCHEMBL2986350 0.85 LMNA (0.65) LMNACYP3A4NR1H2NR1H3POLA1
SCHEMBL15339315 0.85 SOD1 (0.73) CYP3A4NR1H2NR1H3POLA1SOD1
SCHEMBL24591878 0.85 LMNA (0.65) LMNACYP3A4NR1H2NR1H3POLA1
SCHEMBL2994378 0.85 LMNA (0.65) LMNACYP3A4NR1H2NR1H3POLA1
SCHEMBL2993726 0.85 NR1H2 (0.76) LMNACYP3A4NR1H2NR1H3SOD1
SCHEMBL20561234 0.85 NR1H2 (0.76) LMNACYP3A4NR1H2NR1H3SOD1
SCHEMBL2985191 0.84 LMNA (0.64) LMNACYP3A4NR1H2NR1H3POLA1

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-7776558-B2 Human G protein-coupled receptor and modulators thereof for the treatment of cell death-related disorders ARENA PHARMACEUTICALS, INC. (US) 2010-08-17 — — US disclosed
US-7776558-B2 Human G protein-coupled receptor and modulators thereof for the treatment of cell death-related disorders ARENA PHARMACEUTICALS, INC. (US) 2010-08-17 — — US disclosed
US-20080125491-A1 Human G Protein-Coupled Receptor and Modulators Thereof for the Treatment of Cell Death-Related Disorders ARENA PHARMACEUTICALS, INC. (US) 2008-05-29 — — US disclosed
US-20080125491-A1 Human G Protein-Coupled Receptor and Modulators Thereof for the Treatment of Cell Death-Related Disorders ARENA PHARMACEUTICALS, INC. (US) 2008-05-29 — — US disclosed
EP-1604212-A2 MODULATORS OF THE G PROTEIN-COUPLED FORMYL PEPTIDE RECEPTOR-LIKE 2 AND THEIR THERAPEUTIC USE AGAINST CELL DEATH-RELATED DISORDERS Arena Pharmaceuticals, Inc. (US) 2005-12-14 — — EP disclosed
WO-2004083867-A2 MODULATORS OF G PROTEIN-COUPLED FORMYL PEPTIDE RECEPTOR-LIKE 2 AND THEIR THERAPEUTIC USE AGAINST CELL DEATH-RELATED DISORDERS ARENA PHARMACEUTICALS INC. (US) 2004-09-30 — — 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 (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-20080125491-A1 Human G Protein-Coupled Receptor and Modulators Thereof for the Treatment of Cell Death-Related Disorders GPR65, GPR3, GPR52 LMNA 1175/4885CYP3A4 4826/4885NR1H2 1032/4885

“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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