SCHEMBL2587783

SCHEMBL2587783

[c]1ccc(CCN2CCCC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.64
HRH3 Q9Y5N1 8/20 0.62
L3MBTL1 Q9Y468 7/20 0.62
L3MBTL3 Q96JM7 6/20 0.62
MBTD1 Q05BQ5 2/20 0.62
SIGMAR1 Q99720 1/20 0.62
TDP1 Q9NUW8 1/20 0.60
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
TP53BP1 Q12888 1/20 0.50

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
SCHEMBL9367020 0.98 HRH3 (0.66) SLC6A3HRH3L3MBTL1L3MBTL3MBTD1
SCHEMBL422200 0.82 SIGMAR1 (0.56) SLC6A3HRH3L3MBTL1L3MBTL3MBTD1
SCHEMBL27896085 0.82 SIGMAR1 (0.54) SLC6A3HRH3L3MBTL1L3MBTL3MBTD1
SCHEMBL6232146 0.82 KCNH2 (0.55) SLC6A3HRH3L3MBTL1L3MBTL3MBTD1
Water SCHEMBL3683452 0.81 SLC6A3 (0.96) SLC6A3HRH3L3MBTL1L3MBTL3MBTD1
1-Phenethylpiperidine SCHEMBL11404041 0.79 SIGMAR1 (0.96) SLC6A3HRH3L3MBTL1L3MBTL3MBTD1
1-Phenethylpiperidine SCHEMBL27451069 0.79 SIGMAR1 (0.96) SLC6A3HRH3L3MBTL1L3MBTL3MBTD1
1-Phenethylpiperidine SCHEMBL7524827 0.79 SIGMAR1 (0.96) SLC6A3HRH3L3MBTL1L3MBTL3MBTD1
SCHEMBL2876271 0.78 SLC6A3 (1.00) SLC6A3HRH3L3MBTL1L3MBTL3MBTD1
SCHEMBL738784 0.78 HRH3 (0.67) HRH3L3MBTL1L3MBTL3MBTD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240209190-A1 CONJUGATED DIENE-BASED POLYMER, RUBBER COMPOSITION, RUBBER-CROSSLINKED SUBSTANCE, AND TIRE ZS ELASTOMERS CO., LTD. (JP) 2024-06-27 US disclosed
EP-3604365-B1 CONJUGATED DIENE POLYMER AND METHOD FOR PRODUCING CONJUGATED DIENE POLYMER SUMITOMO CHEMICAL CO (JP) 2024-04-24 EP disclosed
CN-113748134-B Conjugated diene copolymer and method for producing conjugated diene copolymer 瑞住合成橡胶株式会社 2024-03-08 CN disclosed
EP-4331862-A1 CONJUGATED DIENE-BASED POLYMER, RUBBER COMPOSITION, RUBBER-CROSSLINKED SUBSTANCE, AND TIRE ZS Elastomers Co., Ltd. (JP) 2024-03-06 EP disclosed
CN-117222674-A Conjugated diene polymer, rubber composition, rubber crosslinked product, and tire 瑞住合成橡胶株式会社 2023-12-12 CN disclosed
CN-110461893-B Conjugated diene polymer and method for producing conjugated diene polymer 住友化学株式会社 2023-10-27 CN disclosed
WO-2023145652-A1 OIL-EXTENDED CONJUGATED DIENE-BASED POLYMER, RUBBER COMPOSITION, CROSSLINKED RUBBER PRODUCT, AND TIRE ZSエラストマー株式会社 2023-08-03 WO disclosed
EP-3495394-B1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER AND METHOD FOR PRODUCING POLYMER COMPOSITION SUMITOMO CHEMICAL CO (JP) 2023-04-12 EP disclosed
US-11377513-B2 Conjugated diene polymer and method for producing conjugated diene polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2022-07-05 US disclosed
US-20220185919-A1 CONJUGATED DIENE COPOLYMER AND METHOD FOR MANUFACTURING CONJUGATED DIENE COPOLYMER ZS ELASTOMERS CO., LTD. (JP) 2022-06-16 US disclosed
US-20120190770-A1 PROCESS FOR PRODUCING CONJUGATED DIENE-BASED POLYMER, CONJUGATED DIENE-BASED POLYMER, AND CONJUGATED DIENE-BASED POLYMER COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED 2012-07-26 US disclosed
US-20120190771-A1 PROCESS FOR PRODUCING CONJUGATED DIENE-BASED POLYMER, CONJUGATED DIENE-BASED POLYMER, AND CONJUGATED DIENE-BASED POLYMER COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED 2012-07-26 US disclosed
CN-102603974-A Process for producing conjugated diene-based polymer, conjugated diene-based polymer, and conjugated diene-based polymer composition SUMITOMO CHEMICAL CO 2012-07-25 CN disclosed
CN-102603975-A Method for producing conjugated diene polymer, and conjugated diene polymer composition SUMITOMO CHEMICAL CO 2012-07-25 CN disclosed
WO-2011137022-A1 AZAINDOLES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-11-03 WO disclosed
US-20100267721-A1 Heterocyclic H3 Antagonists HIGH POINT PHARMACEUTICALS LLC (US) 2010-10-21 US disclosed
EP-2166850-A1 NEW HETEOCYCLIC H3 ANTAGONISTS High Point Pharmaceuticals, LLC (US) 2010-03-31 EP disclosed
EP-2014656-A2 New heteocyclic h3 antagonists TRANSTECH PHARMA (US) 2009-01-14 EP disclosed
WO-2008154126-A1 NEW HETEOCYCLIC H3 ANTAGONISTS HIGH POINT PHARMACEUTICALS, LLC (US) 2008-12-18 WO disclosed
WO-2008020203-A1 PYRIDINYLQUINAZ0LINAMINE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS ASTRAZENECA AB (SE) 2008-02-21 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-20100267721-A1 Heterocyclic H3 Antagonists HRH3, HRH4, HRH2 SLC6A3 419/4885HRH3 1/4885L3MBTL1 2451/4885

“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.