SCHEMBL1127085

SCHEMBL1127085

C1=CC=C2C=CCN2C=C1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL11448164 0.87
SCHEMBL168677 0.82
SCHEMBL27815530 0.80
Hydrochloric Acid SCHEMBL29350580 0.80 KDM4E (0.31)
SCHEMBL29564458 0.80
Ethoxycarbonyl Group SCHEMBL27962731 0.79
Phosphoric Acid SCHEMBL30913886 0.72
Oxalic Acid SCHEMBL30288221 0.72
SCHEMBL1703445 0.71
Pyrimidine SCHEMBL29211317 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107903276-B A kind of method of asymmetric synthesis of cephalotaxine skeleton E ring 河北科技大学 2019-09-17 CN claimed
CN-107903276-A A kind of method of asymmetric synthesis of cephalotaxine skeleton E rings 河北科技大学 2018-04-13 CN claimed
CN-107849054-A NOTCH path signal conduction depressant drug compounds 伊莱利利公司 2018-03-27 CN claimed
CN-105143230-B Tricyclic compound for suppressing CFTR passages 诺华股份有限公司 2017-06-09 CN claimed
CN-104136438-B Quinolyl pyrrolopyrimidyl fused ring compound or salt thereof TAIHO PHARMACEUTICAL CO.,LTD. (JP) 2016-04-06 CN claimed
CN-105143230-A Tricyclic compounds for inhibiting the CFTR channel NOVARTIS AG 2015-12-09 CN claimed
CN-107903276-B A kind of method of asymmetric synthesis of cephalotaxine skeleton E ring 河北科技大学 2019-09-17 CN disclosed
CN-107903276-B A kind of method of asymmetric synthesis of cephalotaxine skeleton E ring 河北科技大学 2019-09-17 CN disclosed
CN-109689027-A Triglycerides aural preparations and application thereof 奥德纳米有限公司 2019-04-26 CN disclosed
CN-109111459-A The ester derivant of cephalotaxine containing salicylic acid, manufacturing method and application thereof 南华大学 2019-01-01 CN disclosed
CN-108391422-A Pyrrolobenzodiazepine antibody-drug conjugates and methods of use 豪夫迈·罗氏有限公司 2018-08-10 CN disclosed
CN-107903276-A A kind of method of asymmetric synthesis of cephalotaxine skeleton E rings 河北科技大学 2018-04-13 CN disclosed
CN-107849054-A NOTCH path signal conduction depressant drug compounds 伊莱利利公司 2018-03-27 CN disclosed
CN-1665780-A Tricyclic steroid hormone nuclear receptor modulators LILLY CO ELI (US) 2005-09-07 CN disclosed
EP-0763036-B1 [a]-ANNELATED PYRROLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF MERCKLE GMBH (DE) 2002-09-11 EP disclosed
EP-0763037-B1 [a]-ANNELATED PYRROLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF MERCKLE GMBH (DE) 2001-11-14 EP disclosed
EP-0763037-A1 [a]-ANNELATED PYRROLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF MERCKLE GMBH (DE) 1997-03-19 EP disclosed
EP-0763036-A1 [a]-ANNELATED PYRROLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF MERCKLE GMBH (DE) 1997-03-19 EP disclosed
WO-1995032972-A1 [a]-ANNELATED PYRROLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF MERCKLE GMBH (DE) 1995-12-07 WO disclosed
WO-1995032970-A1 (a)-ANNELATED PYRROLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF MERCKLE GMBH (DE) 1995-12-07 WO disclosed