SCHEMBL2108945

SCHEMBL2108945

CCCCCCC(C)(C)[C](C)C

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 6/20 0.43
TSHR P16473 1/20 0.42
THRB P10828 1/20 0.42
FDPS P14324 9/20 0.41
SMPD1 P17405 2/20 0.40
CES2 O00748 1/20 0.40
LPAR1 Q92633 1/20 0.40
LPAR3 Q9UBY5 1/20 0.40

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
SCHEMBL10767833 1.00 GGPS1 (0.43) GGPS1TSHRTHRBFDPSSMPD1
SCHEMBL9754327 1.00 GGPS1 (0.43) GGPS1TSHRTHRBFDPSSMPD1
SCHEMBL28277589 1.00 GGPS1 (0.43) GGPS1TSHRTHRBFDPSSMPD1
SCHEMBL28161118 1.00 GGPS1 (0.43) GGPS1TSHRTHRBFDPSSMPD1
SCHEMBL100346 1.00 GGPS1 (0.43) GGPS1TSHRTHRBFDPSSMPD1
SCHEMBL4869449 1.00 GGPS1 (0.43) GGPS1TSHRTHRBFDPSSMPD1
SCHEMBL10759608 1.00 GGPS1 (0.43) GGPS1TSHRTHRBFDPSSMPD1
SCHEMBL18305913 1.00 GGPS1 (0.43) GGPS1TSHRTHRBFDPSSMPD1
SCHEMBL28344630 1.00 GGPS1 (0.43) GGPS1TSHRTHRBFDPSSMPD1
SCHEMBL2108808 0.97 FDPS (0.39) GGPS1TSHRTHRBFDPSSMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113874371-B Preparation method of tri-fused ring compound and intermediate thereof 诺和诺德股份有限公司 2024-04-16 CN disclosed
EP-4338592-A1 USE OF COMPOUND FOR IMPROVING THE EFFICACY OF HERBICIDES BASF SE (DE) 2024-03-20 EP disclosed
CN-117624222-A Aza large volume anion-cation complex, preparation method and application thereof 中化学科学技术研究有限公司 2024-03-01 CN disclosed
CN-116414012-A Electropositive polymer charge control agent and preparation method and application thereof 邯郸汉光办公自动化耗材有限公司 2023-07-11 CN disclosed
CN-112094266-B Pyrrolopyridinone compound, preparation method, composition and application thereof 中国科学院上海药物研究所 2023-03-21 CN disclosed
CN-115315418-A Cannabidiol prodrug, and pharmaceutical composition and application thereof 山东绿叶制药有限公司 2022-11-08 CN disclosed
CN-114981257-A Substituted pyrazolopiperidinecarboxylic acids 拜耳公司 2022-08-30 CN disclosed
CN-113135966-A Bicyclic derivatives of heterocyclic glucoside and preparation method and application thereof 华润双鹤药业股份有限公司 2021-07-20 CN disclosed
CN-111607055-B High molecular weight polyurethane based on dynamic reversible covalent bond and preparation method and application thereof 中国科学院化学研究所 2021-07-16 CN disclosed
CN-113004291-A Metalloporphyrin-based molecular glass chemical amplification photoresist and preparation method and application thereof 中国科学院化学研究所 2021-06-22 CN disclosed
US-20070185208-A1 Amide compound KAO CORPORATION (JP) 2007-08-09 US disclosed
CN-1938408-A Lubricating composition for industrial machinery NIPPON OIL CORP (JP) 2007-03-28 CN disclosed
CN-1930274-A Refrigerating machine oil NIPPON OIL CORP (JP) 2007-03-14 CN disclosed
CN-1930276-A Refrigerating machine oil composition NIPPON OIL CORP (JP) 2007-03-14 CN disclosed
CN-1836030-A Refrigerating machine oil composition NIPPON OIL CORP (JP) 2006-09-20 CN disclosed
CN-1221647-C Refrigerating oil composition for carbon dioxide refrigerant IDEMITSU KOSAN CO (JP) 2005-10-05 CN disclosed
CN-1208440-C Refrigerating machine oil composition IDEMITSU KOSAN CO (JP) 2005-06-29 CN disclosed
CN-1434106-A Refrigerating machine oil composition IDEMITSU KOSAN CO (JP) 2003-08-06 CN disclosed
CN-1415004-A Refrigerating oil composition for carbon dioxide refrigerant IDEMITSU KOSAN CO (JP) 2003-04-30 CN disclosed
CN-1096497-C Refrigerating machine oil composition IDEMITSU KOSAN CO (JP) 2002-12-18 CN 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-20070185208-A1 Amide compound H1-0, H1-2, H1-4 GGPS1 75/4885TSHR 1544/4885THRB 3146/4885

“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.