SCHEMBL4196341

SCHEMBL4196341

Oc1ccc([C](c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.64
ESR1 P03372 8/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
MAPT P10636 3/20 0.56
LMNA P02545 2/20 0.56
RAB9A P51151 2/20 0.56
CA12 O43570 3/20 0.56
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA3 P07451 3/20 0.56
CA4 P22748 3/20 0.56
CA9 Q16790 3/20 0.56
CA14 Q9ULX7 3/20 0.56
GLA P06280 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
MMP3 P08254 1/20 0.52
BCL2L1 Q07817 1/20 0.52
ESR2 Q92731 4/20 0.50
TYR P14679 2/20 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
SCHEMBL5341263 0.87 MAPT (0.61) CES2ESR1MEN1KMT2AMAPT
SCHEMBL8598488 0.84 ESR1 (0.52) CES2ESR1MEN1KMT2AMAPT
SCHEMBL143 0.84 CES1 (0.53) CES2MEN1KMT2AMAPTLMNA
SCHEMBL5024814 0.82 CES2 (0.60) CES2LMNACA1CA2CA4
SCHEMBL68100 0.82 ESR1 (0.70) CES2ESR1MEN1KMT2AMAPT
SCHEMBL68101 0.82 ESR1 (0.70) CES2ESR1MEN1KMT2AMAPT
SCHEMBL9723455 0.82 ESR1 (0.70) CES2ESR1MEN1KMT2AMAPT
SCHEMBL14354292 0.82 ESR1 (0.70) CES2ESR1MEN1KMT2AMAPT
SCHEMBL9891113 0.82 ESR1 (0.70) CES2ESR1MEN1KMT2AMAPT
Bromide SCHEMBL28972076 0.81 CES1 (0.50) CES2MEN1KMT2AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117295525-A Cell penetrating peptide conjugates and methods of use thereof 牛津大学科技创新有限公司 2023-12-26 CN disclosed
WO-2023196499-A1 SUBSTRATE CLEAVAGE FOR NUCLEIC ACID SYNTHESIS Twist Bioscience Corporation (US) 2023-10-12 WO disclosed
CN-114044896-B Uniform sequence-defined polyurethanes and their use as molecular markers 国立科学研究中心 2023-08-08 CN disclosed
US-11359054-B2 Uniform sequence-defined polyurethanes and uses thereof as molecular labels CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2022-06-14 US disclosed
EP-3455279-B1 UNIFORM SEQUENCE-DEFINED POLYURETHANES AND USES THEREOF AS MOLECULAR LABELS CENTRE NAT RECH SCIENT (FR) 2022-04-13 EP disclosed
CN-114044896-A Polyurethane with uniform sequence definition and application thereof as molecular marker 国立科学研究中心 2022-02-15 CN disclosed
CN-109153782-B Polyurethane with uniform sequence definition and application thereof as molecular marker 国立科学研究中心 2021-12-17 CN disclosed
CN-113453723-A Joint 牛津大学科技创新有限公司 2021-09-28 CN disclosed
US-20200407503-A1 UNIFORM SEQUENCE-DEFINED POLYURETHANES AND USES THEREOF AS MOLECULAR LABELS UNIVERSITÉ D'AIX-MARSEILLE (FR) 2020-12-31 US disclosed
EP-3455279-A1 UNIFORM SEQUENCE-DEFINED POLYURETHANES AND USES THEREOF AS MOLECULAR LABELS Centre National De La Recherche Scientifique (FR) 2019-03-20 EP disclosed
WO-2002079278-A1 EFFICIENT METHODS FOR SOLID PHASE SYNTHESIS USING TRITYL CHLORIDE RESINS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2002-10-10 WO disclosed
EP-0871896-B1 A METHOD OF DETERMINING OXYGEN CONCENTRATION IN A SAMPLE NYCOMED IMAGING AS (NO) 2002-01-30 EP disclosed
US-6256527-B1 Method for determining oxygen concentration NYCOMED IMAGING AS (NO) 2001-07-03 US disclosed
EP-0832054-B1 HETEROCYCLIC METHYL FREE RADICALS AS IMAGE ENHANCING AGENTS NYCOMED IMAGING AS (NO) 2000-12-27 EP disclosed
WO-2000026262-A2 FUNCTIONALIZED POLYMERIC SUBSTRATES FOR BINDING MOLECULAR MOIETIES MITOKOR (US) 2000-05-11 WO disclosed
EP-0871896-A1 A METHOD OF DETERMINING OXYGEN CONCENTRATION IN A SAMPLE NYCOMED IMAGING AS (NO) 1998-10-21 EP disclosed
US-5765562-A IN A SAMPLE NYCOMED IMAGING AS (NO) 1998-06-16 US disclosed
EP-0832054-A1 HETEROCYCLIC METHYL FREE RADICALS AS IMAGE ENHANCING AGENTS NYCOMED IMAGING AS (NO) 1998-04-01 EP disclosed
WO-1997009633-A1 A METHOD OF DETERMINING OXYGEN CONCENTRATION IN A SAMPLE NYCOMED IMAGING A/S (NO) 1997-03-13 WO disclosed
WO-1996039367-A1 HETEROCYCLIC METHYL FREE RADICALS AS IMAGE ENHANCING AGENTS NYCOMED IMAGING A/S (NO) 1996-12-12 WO disclosed