SCHEMBL12464183

SCHEMBL12464183

CN(C)c1ccc2c(c1)Oc1c(ccc3cccc(O)c13)C21OC(=O)c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
TDP1 Q9NUW8 4/20 0.51
HTT P42858 2/20 0.51
FTO Q9C0B1 2/20 0.51
HPGD P15428 2/20 0.51
RECQL P46063 2/20 0.51
BLM P54132 2/20 0.51
PRMT1 Q99873 2/20 0.51
ACE2 Q9BYF1 2/20 0.51
CYP2C19 P33261 2/20 0.51
SMAD3 P84022 1/20 0.51
GNG2 P59768 1/20 0.48
GNB1 P62873 1/20 0.48
LMNA P02545 4/20 0.45
ALDH1A1 P00352 2/20 0.45
USP2 O75604 2/20 0.45
CYP3A4 P08684 3/20 0.44
HIF1A Q16665 2/20 0.44

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
SCHEMBL19657366 0.88 MEN1 (0.46) MAPTMEN1KMT2ATDP1HTT
SCHEMBL14477011 0.88 FTO (0.68) MAPTMEN1KMT2ATDP1HTT
SCHEMBL14477017 0.86 MAPT (0.53) MAPTMEN1KMT2ATDP1HTT
SCHEMBL14477019 0.85 GNG2 (0.65) MAPTMEN1KMT2ATDP1HTT
SCHEMBL14477025 0.82 FTO (0.63) MAPTMEN1KMT2ATDP1HTT
SCHEMBL5271242 0.82 FTO (0.60) MAPTMEN1KMT2ATDP1HTT
SCHEMBL9610878 0.81 FTO (0.66) MAPTMEN1KMT2ATDP1HTT
SCHEMBL31580046 0.81 FTO (0.66) MAPTMEN1KMT2ATDP1HTT
SCHEMBL8230429 0.81 MEN1 (0.46) MAPTMEN1KMT2ATDP1HTT
SCHEMBL14476515 0.80 ALDH1A1 (0.34) MEN1KMT2ATDP1HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11191850-B2 Molecular probes for detection and imaging of pancreatic cancer PORTLAND STATE UNIVERSITY (US) 2021-12-07 US disclosed
EP-3464293-B1 MOLECULAR PROBES FOR DETECTION AND IMAGING OF PANCREATIC CANCER UNIV PORTLAND STATE (US) 2021-06-23 EP disclosed
US-20200330612-A1 MOLECULAR PROBES FOR DETECTION AND IMAGING OF PANCREATIC CANCER PORTLAND STATE UNIVERSITY (US) 2020-10-22 US disclosed
US-10197574-B2 Analyte detection using near-infrared fluorophores PORTLAND STATE UNIVERSITY (US) 2019-02-05 US disclosed
US-9958451-B2 Near-infrared fluorescent dyes with large stokes shifts PORTLAND STATE UNIVERSITY (US) 2018-05-01 US disclosed
US-9958451-B2 Near-infrared fluorescent dyes with large stokes shifts PORTLAND STATE UNIVERSITY (US) 2018-05-01 US disclosed
WO-2017205350-A1 MOLECULAR PROBES FOR DETECTION AND IMAGING OF PANCREATIC CANCER PORTLAND STATE UNIVERSITY (US) 2017-11-30 WO disclosed
US-20160223558-A1 ANALYTE DETECTION USING NEAR-INFRARED FLUOROPHORES PORTLAND STATE UNIVERSITY (US) 2016-08-04 US disclosed
US-20160223558-A1 ANALYTE DETECTION USING NEAR-INFRARED FLUOROPHORES PORTLAND STATE UNIVERSITY (US) 2016-08-04 US disclosed
US-20160154001-A1 NEAR-INFRARED FLUORESCENT DYES WITH LARGE STOKES SHIFTS PORTLAND STATE UNIVERSITY (US) 2016-06-02 US disclosed
US-9250246-B2 Near-infrared fluorescent dyes with large stokes shifts PORTLAND STATE UNIVERSITY (US) 2016-02-02 US disclosed
US-8927727-B2 Thiol detection THE STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF PORTLAND STATE UNIVERSITY (US) 2015-01-06 US disclosed
US-8927727-B2 Thiol detection THE STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF PORTLAND STATE UNIVERSITY (US) 2015-01-06 US disclosed
US-20140120628-A1 NEAR-INFRARED FLUORESCENT DYES WITH LARGE STOKES SHIFTS THE OREGON STATE BOARD OF HIGHER EDUCATION ON BEHALF OF PORTLAND STATE UNIVERSITY (US) 2014-05-01 US disclosed
US-20140120628-A1 NEAR-INFRARED FLUORESCENT DYES WITH LARGE STOKES SHIFTS THE OREGON STATE BOARD OF HIGHER EDUCATION ON BEHALF OF PORTLAND STATE UNIVERSITY (US) 2014-05-01 US disclosed
WO-2013003812-A2 ANALYTE DETECTION USING NEAR-INFRARED FLUOROPHORES THE OREGON STATE BOARD OF HIGHER EDUCATION ON BEHALF OF PORTLAND STATE UNIVERSITY (US) 2013-01-03 WO disclosed
WO-2013003815-A2 NEAR-INFRARED FLUORESCENT DYES WITH LARGE STOKES SHIFTS THE OREGON STATE BOARD OF HIGHER EDUCATION ON BEHALF OF PORTLAND STATE UNIVERSITY (US) 2013-01-03 WO disclosed
US-20120276649-A1 THIOL DETECTION THE OREGON BOARD OF HIGHER EDUCATION ON BEHALF OF PORTLAND STATE UNIVERSITY 2012-11-01 US disclosed
US-20120276649-A1 THIOL DETECTION THE OREGON BOARD OF HIGHER EDUCATION ON BEHALF OF PORTLAND STATE UNIVERSITY 2012-11-01 US disclosed
WO-2011082354-A2 THIOL DETECTION THE STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF PORTLAND STATE UNIVERSITY (US) 2011-07-07 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 (5 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-10197574-B2 Analyte detection using near-infrared fluorophores BLVRB, CBR3, AKR7A2 MAPT 4472/4885MEN1 3653/4885KMT2A 2373/4885
US-20160223558-A1 ANALYTE DETECTION USING NEAR-INFRARED FLUOROPHORES BLVRB, CBR3, AKR7A2 MAPT 4472/4885MEN1 3653/4885KMT2A 2373/4885
US-20200330612-A1 MOLECULAR PROBES FOR DETECTION AND IMAGING OF PANCREATIC CANCER RNASE1, AMY2A, ANXA4 MAPT 4540/4885MEN1 1072/4885KMT2A 2406/4885
US-20120276649-A1 THIOL DETECTION GLO1, AHCY, BHMT2 MAPT 3741/4885MEN1 3973/4885KMT2A 2155/4885
US-11191850-B2 Molecular probes for detection and imaging of pancreatic cancer RNASE1, AMY2A, ANXA4 MAPT 4540/4885MEN1 1072/4885KMT2A 2406/4885

“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.