SCHEMBL1934073

SCHEMBL1934073

C=C(c1ccccc1)C1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.42
POLB P06746 1/20 0.42
HPGD P15428 1/20 0.41
MCL1 Q07820 1/20 0.40
KCNK3 O14649 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
LMNA P02545 1/20 0.39
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
RAB9A P51151 2/20 0.37
GAA P10253 2/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
NPC1 O15118 1/20 0.37
FASN P49327 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL394357 0.98 POLB (0.45) ELANEPOLBHPGDMCL1KCNK3
SCHEMBL5734309 0.98 POLB (0.45) ELANEPOLBHPGDMCL1KCNK3
SCHEMBL6858730 0.95 MTNR1A (0.41) ELANEPOLBHPGDMCL1KCNK3
SCHEMBL4425242 0.93 ELANE (0.41) ELANEGAAHTTALDH1A1
SCHEMBL12064486 0.81 HRH3 (0.46) LMNA
SCHEMBL9966338 0.78 POLB (0.45) POLBHPGDRAB9A
SCHEMBL18905527 0.78 CHRM2 (0.38) ELANEPOLBLMNA
SCHEMBL23893550 0.78 KDM1A (0.36) ELANELMNA
SCHEMBL17073070 0.78 ELANE (0.33) ELANEGAA
SCHEMBL18856453 0.78 MEN1 (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9296832-B2 Anionic polymerization methods for producing functionalized polymers BRIDGESTONE CORPORATION (JP) 2016-03-29 US claimed
CN-102725315-B Anionic polymerization methods for producing functionalized polymers BRIDGESTONE CO.,LTD. (JP) 2014-10-22 CN claimed
EP-2504365-B1 ANIONIC POLYMERIZATION METHODS FOR PRODUCING FUNCTIONALIZED POLYMERS BRIDGESTONE CORP (JP) 2014-05-14 EP claimed
US-20130030133-A1 ANIONIC POLYMERIZATION METHODS FOR PRODUCING FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2013-01-31 US claimed
CN-102725315-A Anionic polymerization methods for producing functionalized polymers BRIDGESTONE CORP 2012-10-10 CN claimed
EP-2504365-A1 ANIONIC POLYMERIZATION METHODS FOR PRODUCING FUNCTIONALIZED POLYMERS Bridgestone Corporation (JP) 2012-10-03 EP claimed
WO-2011066405-A1 ANIONIC POLYMERIZATION METHODS FOR PRODUCING FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2011-06-03 WO claimed
CN-113880871-B Preparation method of saturated monoboron compound 中国科学院兰州化学物理研究所 2022-08-23 CN disclosed
CN-113880871-A Preparation method of saturated monoboron compound 中国科学院兰州化学物理研究所 2022-01-04 CN disclosed
CN-111689956-B Resolution method of quinine compound containing quaternary ammonium group 银谷制药有限责任公司 2021-12-24 CN disclosed
CN-111689956-A Resolution method of quinine compound containing quaternary ammonium group 银谷制药有限责任公司 2020-09-22 CN disclosed
US-9296832-B2 Anionic polymerization methods for producing functionalized polymers BRIDGESTONE CORPORATION (JP) 2016-03-29 US disclosed
CN-102725315-B Anionic polymerization methods for producing functionalized polymers BRIDGESTONE CO.,LTD. (JP) 2014-10-22 CN disclosed
WO-2011066405-A1 ANIONIC POLYMERIZATION METHODS FOR PRODUCING FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2011-06-03 WO disclosed
US-6835860-B2 Halogenation with iodine monochloride and iodine monobromide in an aqueous solution, forming a chemical intermediate for the preparation of indinavir, an HIV protease enzyme inhibitor MERCK & CO., INC. 2004-12-28 US disclosed
US-20030187291-A1 Halogenation with iodine monochloride and iodine monobromide in an aqueous solution, forming a chemical intermediate for the preparation of indinavir, an HIV protease enzyme inhibitor MERCK SHARP & DOHME CORP. 2003-10-02 US disclosed
US-6372911-B1 REACTING COMPOUND CONTAINING AT LEAST ONE CARBON-CARBON DOUBLE BOND WITH CARBAMATE IN AQUEOUS SOLVENT IN PRESENCE OF BASE, OSMIUM CATALYST, CO-OXIDANT, AND OPTIONALLY ASYMMETRIC LIGAND, TO FORM REACTION MIXTURE CONTAINING BETA-HYDROXY CARBAMATE MERCK & CO., INC. 2002-04-16 US disclosed
US-5708168-A FOR TREATING OR PREVENTING NEURONAL LOSS STATE OF OREGON, ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION, ACTING FOR AND ON BEHALF OF THE OREGON HEALTH SCIENCES UNIVERSITY AND THE UNIVERSITY OF OREGON, EUGENE OREGON (US) 1998-01-13 US disclosed
WO-1996015112-A1 AZEPINE SYNTHESIS VIA A DIELS-ALDER REACTION ACEA PHARMACEUTICALS, INC. (US) 1996-05-23 WO disclosed
US-5476933-A Condensation, ring expansion STATE OF OREGON, ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION, ACTING FOR AND ON BEHALF OF THE OREGON HEALTH SCIENCES UNIVERSITY AND THE UNIVERSITY OF OREGON (US) 1995-12-19 US 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-20030187291-A1 Halogenation with iodine monochloride and iodine monobromide in an aqueous solution, forming a chemical intermediate for the preparation of indinavir, an HIV protease enzyme inhibitor IDE, MMP1, CYP3A4 ELANE 689/4885POLB 379/4885HPGD 1273/4885

“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.