SCHEMBL6640418

SCHEMBL6640418

COc1ccc(-c2cn3ccccc3c2C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.61
ALDH1A1 P00352 9/20 0.61
GAA P10253 5/20 0.61
POLB P06746 2/20 0.61
HTT P42858 1/20 0.61
HRH3 Q9Y5N1 4/20 0.57
RAB9A P51151 6/20 0.52
NPC1 O15118 5/20 0.52
PKM P14618 2/20 0.52
EPHX2 P34913 1/20 0.52
QPCT Q16769 1/20 0.48
QPCTL Q9NXS2 1/20 0.48
MEN1 O00255 6/20 0.45
HPGD P15428 6/20 0.45
KMT2A Q03164 6/20 0.45
SMN1; SMN2 Q16637 5/20 0.45
MAPT P10636 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ATM Q13315 1/20 0.45
CYP1A2 P05177 1/20 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
SCHEMBL1435590 0.83 KDM4E (0.54) KDM4EALDH1A1GAAPOLBHTT
SCHEMBL6641997 0.83 KDM4E (0.56) KDM4EALDH1A1GAAPOLBHTT
SCHEMBL6844539 0.81 KDM4E (0.47) KDM4EALDH1A1GAAPOLBHTT
SCHEMBL6641388 0.81 HRH3 (0.50) KDM4EALDH1A1GAAPOLBHTT
SCHEMBL6638755 0.81 HRH3 (0.61) KDM4EALDH1A1GAAPOLBHTT
SCHEMBL11285011 0.78 KDM4E (0.50) KDM4EALDH1A1GAAPOLBHTT
SCHEMBL19220371 0.77 HPGD (0.42) KDM4EALDH1A1GAAPOLBHTT
SCHEMBL6637278 0.76 HRH3 (0.62) KDM4EALDH1A1GAAPOLBHTT
SCHEMBL6636102 0.74 HRH3 (1.00) HRH3
SCHEMBL11079317 0.73 ALDH1A1 (0.67) KDM4EALDH1A1GAAPOLBHTT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10562913-B2 Indolizine-based dyes for dye-sensitized solar cell UNIVERSITY OF MISSISSIPPI (US) 2020-02-18 US disclosed
US-20170226125-A1 INDOLIZINE-BASED DYES FOR DYE-SENSITIZED SOLAR CELL UNIVERSITY OF MISSISSIPPI 2017-08-10 US disclosed
US-20170226125-A1 INDOLIZINE-BASED DYES FOR DYE-SENSITIZED SOLAR CELL UNIVERSITY OF MISSISSIPPI 2017-08-10 US disclosed
EP-1268479-B1 PHENYL-SUBSTITUTED INDOLIZINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 LIGANDS ORTHO MCNEIL PHARM INC (US) 2004-01-28 EP disclosed
EP-1268479-A1 PHENYL-SUBSTITUTED INDOLIZINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 LIGANDS Ortho-McNeil Pharmaceutical, Inc. (US) 2003-01-02 EP disclosed
US-20010051632-A1 Phenyl-substituted indolizines and tetrahydroindolizines ORTHO MCNEIL PHARMACEUTICAL, INC. 2001-12-13 US disclosed
WO-2001074814-A1 PHENYL-SUBSTITUTED INDOLIZINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 LIGANDS ORTHO MCNEIL PHARMACEUTICAL, INC. (US) 2001-10-11 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 (3 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-20170226125-A1 INDOLIZINE-BASED DYES FOR DYE-SENSITIZED SOLAR CELL INMT, IDO1, IDO2 KDM4E 1805/4885ALDH1A1 1602/4885GAA 3253/4885
US-20010051632-A1 Phenyl-substituted indolizines and tetrahydroindolizines TPH2, TPH1, IDO2 KDM4E 1223/4885ALDH1A1 967/4885GAA 2400/4885
US-10562913-B2 Indolizine-based dyes for dye-sensitized solar cell INMT, IDO1, IDO2 KDM4E 1805/4885ALDH1A1 1602/4885GAA 3253/4885

“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.