SCHEMBL2967658

SCHEMBL2967658

Cc1cn2ccccc2c1N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.36
ALDH1A1 P00352 12/20 0.36
MAPT P10636 5/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
HPGD P15428 8/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HTR6 P50406 1/20 0.36
GRM5 P41594 1/20 0.36
GAA P10253 5/20 0.36
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
CYP3A4 P08684 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 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
SCHEMBL7166909 0.78 HRH3 (0.40) KDM4EALDH1A1MAPTL3MBTL1HPGD
Ammonia Solution, Strong SCHEMBL29032591 0.77 HRH3 (0.39) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL14639772 0.75 GABRA1 (0.32) KDM4EALDH1A1MAPTL3MBTL1HPGD
Formamide SCHEMBL28844183 0.75 HRH3 (0.36) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL1436027 0.72 HRH3 (0.40) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL26029113 0.72 ALDH1A1 (0.42) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL1646402 0.72 ALDH1A1 (0.45) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL321823 0.72 KDM4E (0.40) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL25169306 0.72 KDM4E (0.47) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL7167022 0.72 TAAR1 (0.40) KDM4EALDH1A1MAPTL3MBTL1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776107-B2 Aminoindolizines, dyeing composition comprising at least one aminoindolizine, methods and uses thereof L'OREAL S.A. (FR) 2010-08-17 US disclosed
US-7776107-B2 Aminoindolizines, dyeing composition comprising at least one aminoindolizine, methods and uses thereof L'OREAL S.A. (FR) 2010-08-17 US disclosed
US-7776107-B2 Aminoindolizines, dyeing composition comprising at least one aminoindolizine, methods and uses thereof L'OREAL S.A. (FR) 2010-08-17 US disclosed
US-20090235467-A1 NEW AMINOINDOLIZINES, DYEING COMPOSITION COMPRISING AT LEAST ONE AMINOINDOLIZINE, METHODS AND USES THEREOF L'OREAL S.A. (FR) 2009-09-24 US disclosed
US-20090235467-A1 NEW AMINOINDOLIZINES, DYEING COMPOSITION COMPRISING AT LEAST ONE AMINOINDOLIZINE, METHODS AND USES THEREOF L'OREAL S.A. (FR) 2009-09-24 US disclosed
US-20090235467-A1 NEW AMINOINDOLIZINES, DYEING COMPOSITION COMPRISING AT LEAST ONE AMINOINDOLIZINE, METHODS AND USES THEREOF L'OREAL S.A. (FR) 2009-09-24 US disclosed
EP-2093226-A1 New aminoindolizines, tinctorial composition comprising an aminoindolizine, methods and uses L'Oreal (FR) 2009-08-26 EP disclosed
EP-2093226-A1 New aminoindolizines, tinctorial composition comprising an aminoindolizine, methods and uses L'Oreal (FR) 2009-08-26 EP disclosed
EP-1495023-B1 NOVEL 1,2,3-SUBSTITUTED INDOLIZINE DERIVATIVES, INHIBITORS OF FGFS, METHOD FOR MAKING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI AVENTIS (FR) 2005-09-07 EP disclosed
EP-1495023-A1 NOVEL 1,2,3-SUBSTITUTED INDOLIZINE DERIVATIVES, INHIBITORS OF FGFS, METHOD FOR MAKING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Sanofi-Aventis (FR) 2005-01-12 EP disclosed
WO-2003084956-A1 NOVEL 1,2,3-SUBSTITUTED INDOLIZINE DERIVATIVES, INHIBITORS OF FGFS, METHOD FOR MAKING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI-AVENTIS (FR) 2003-10-16 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 (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-20090235467-A1 NEW AMINOINDOLIZINES, DYEING COMPOSITION COMPRISING AT LEAST ONE AMINOINDOLIZINE, METHODS AND USES THEREOF KRT18, AADAT, ALAD KDM4E 977/4885ALDH1A1 723/4885MAPT 285/4885

“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.