SCHEMBL1237995

SCHEMBL1237995

CC1(N)C2CC3CC(C2)CC1C3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
SLC22A2 O15244 1/20 0.38
SLC22A1 O15245 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38
STAT6 P42226 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
SLC47A1 Q96FL8 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
POLB P06746 1/20 0.36
THRB P10828 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
Hydrochloric Acid SCHEMBL1237955 0.97 LMNA (0.41) LMNASLC22A2SLC22A1GRIN2DGRIN3B
Sulfuric Acid SCHEMBL15211001 0.85 KCNH2 (0.36)
SCHEMBL27982220 0.85
SCHEMBL27309162 0.73 LMNA (0.42) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL1397352 0.73 MAPT (0.33)
SCHEMBL19355051 0.71
Water SCHEMBL6938407 0.71 HSD11B1 (0.32)
SCHEMBL13718444 0.71
SCHEMBL2264953 0.69 PKM (0.39) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL6526108 0.69 GRIN2D (0.40) LMNASLC22A2SLC22A1GRIN2DGRIN3B

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9301950-B2 Adamantane analogs THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-04-05 US claimed
EP-2817003-A1 COMPOUNDS FOR TREATING PARVOVIRUS INFECTION Aratana Therapeutics NV (BE) 2014-12-31 EP claimed
CN-104220052-A Compounds for treating parvovirus infection OKAPI SCIENCES NV 2014-12-17 CN claimed
WO-2013124403-A1 COMPOUNDS FOR TREATING PARVOVIRUS INFECTION OKAPI SCIENCES NV (BE) 2013-08-29 WO claimed
US-20120270917-A1 ADAMANTANE ANALOGS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2012-10-25 US claimed
WO-2011022191-A1 ADAMANTANE ANALOGS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-02-24 WO claimed
EP-0647629-B1 Neurotensin active substituted 1-naphthylpyrazole-3-carboxamides, their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1999-07-07 EP claimed
US-9840465-B2 Antiviral compounds UNIV BRIGHAM YOUNG (US) 2017-12-12 US disclosed
US-9726976-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-08 US disclosed
US-9726976-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-08 US disclosed
US-9726976-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-08 US disclosed
US-9301950-B2 Adamantane analogs THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-04-05 US disclosed
US-9301950-B2 Adamantane analogs THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-04-05 US disclosed
US-20110065041-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-17 US disclosed
WO-2011022191-A1 ADAMANTANE ANALOGS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-02-24 WO disclosed
WO-2011022191-A1 ADAMANTANE ANALOGS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-02-24 WO disclosed
US-20080234259-A1 Novel Cannabinoid Receptor Ligands, Pharmaceutical Compositions Containing Them, and Process For Their Preparation GLENMARK PHARMACEUTICALS S.A. (CH) 2008-09-25 US disclosed
CN-101238107-A Novel cannabinoid receptor ligands, pharmaceutical compositions containing them, and process for their preparation GLENMARK PHARMACEUTICALS SA (CH) 2008-08-06 CN disclosed
EP-1902034-A1 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESS FOR THEIR PREPARATION Glenmark Pharmaceuticals S.A. (CH) 2008-03-26 EP disclosed
WO-2006129178-A1 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESS FOR THEIR PREPARATION GLENMARK PHARMACEUTICALS S.A. (US) 2006-12-07 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-20120270917-A1 ADAMANTANE ANALOGS HAVCR2, ADORA2A, ADORA1 LMNA 2893/4885SLC22A2 1112/4885SLC22A1 993/4885
US-20080234259-A1 Novel Cannabinoid Receptor Ligands, Pharmaceutical Compositions Containing Them, and Process For Their Preparation CNR2, CNR1, OPRL1 LMNA 2774/4885SLC22A2 4061/4885SLC22A1 4151/4885

“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.