SCHEMBL5969914

SCHEMBL5969914

O=C(c1ccc2ocnc2c1)N1CC=CCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.50
CTNNB1 P35222 4/20 0.46
WNT3A P56704 4/20 0.46
CRBN Q96SW2 1/20 0.44
NAMPT P43490 1/20 0.41
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
GAA P10253 1/20 0.41
KLK3 P07288 1/20 0.41
HPGD P15428 2/20 0.40
GRIA3 P42263 1/20 0.39
GRIA4 P48058 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
AKR1C3 P42330 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
WNT1 P04628 1/20 0.37
GSK3B P49841 1/20 0.37

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
SCHEMBL5823589 0.90 CRBN (0.54) FASNCRBNNAMPTALDH1A1KMT2A
SCHEMBL13216394 0.81 HPGD (0.61) FASNCTNNB1WNT3AALDH1A1HPGD
SCHEMBL5823576 0.79 HPGD (0.65) ALDH1A1KMT2AHPGDGRIA3GRIA4
SCHEMBL5756447 0.77 GRIA3 (0.66) NAMPTALDH1A1KMT2AHPGDGRIA3
SCHEMBL14176980 0.74 HSD11B1 (0.47) HPGDAKR1C3HRH3PLA2G7
SCHEMBL13486223 0.72 KDM4E (0.59) CTNNB1WNT3AALDH1A1KMT2AMEN1
SCHEMBL7559546 0.72 CA12 (0.56) GRIA3GRIA4MAPT
SCHEMBL25416254 0.71 HPGD (0.58) FASNCRBNALDH1A1KMT2AHPGD
SCHEMBL27775524 0.71 CTNNB1 (0.57) FASNCTNNB1WNT3ANAMPTALDH1A1
SCHEMBL703854 0.71 CTNNB1 (0.65) FASNCTNNB1WNT3ANAMPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060063707-A1 Compositions for enhancing memory and methods therefor LIFELIKE BIOMATIC, INC. (US) 2006-03-23 US claimed
US-20170209425-A1 METHODS AND COMPOSITIONS FOR TREATING PATHOLOGIES ASSOCIATED WITH BDNF SIGNALING UNIV CASE WESTERN RESERVE (US) 2017-07-27 US disclosed
US-20170209425-A1 METHODS AND COMPOSITIONS FOR TREATING PATHOLOGIES ASSOCIATED WITH BDNF SIGNALING UNIV CASE WESTERN RESERVE (US) 2017-07-27 US disclosed
EP-0883403-B1 METHOD FOR TREATING SEXUAL DYSFUNCTIONS UNIV CALIFORNIA (US) 2010-08-25 EP disclosed
US-20100035877-A1 METHODS AND COMPOSITIONS FOR TREATING PATHOLOGIES ASSOCIATED WITH BDNF SIGNALING NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR NIH 2010-02-11 US disclosed
US-20100035877-A1 METHODS AND COMPOSITIONS FOR TREATING PATHOLOGIES ASSOCIATED WITH BDNF SIGNALING NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR NIH 2010-02-11 US disclosed
US-20080176793-A1 UPREGULATING ACTIVITY OR EXPRESSION OF BDNF TO MITIGATE COGNITIVE IMPAIRMENT IN ASYMPTOMATIC HUNTINGTON'S SUBJECTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-07-24 US disclosed
US-20080139472-A1 UPREGULATING BDNF LEVELS TO MITIGATE MENTAL RETARDATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-06-12 US disclosed
US-20060063707-A1 Compositions for enhancing memory and methods therefor LIFELIKE BIOMATIC, INC. (US) 2006-03-23 US 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-20060063707-A1 Compositions for enhancing memory and methods therefor GRIN1, GRIN3A, GRIN2A FASN 3748/4885CTNNB1 3859/4885WNT3A 3033/4885
US-20080176793-A1 UPREGULATING ACTIVITY OR EXPRESSION OF BDNF TO MITIGATE COGNITIVE IMPAIRMENT IN ASYMPTOMATIC HUNTINGTON'S SUBJECTS BDNF, HTT, NTRK2 FASN 1075/4885CTNNB1 4099/4885WNT3A 2701/4885
US-20170209425-A1 METHODS AND COMPOSITIONS FOR TREATING PATHOLOGIES ASSOCIATED WITH BDNF SIGNALING NTRK2, BDNF, NGF FASN 3187/4885CTNNB1 4086/4885WNT3A 1462/4885
US-20080139472-A1 UPREGULATING BDNF LEVELS TO MITIGATE MENTAL RETARDATION BDNF, MECP2, NTRK2 FASN 4074/4885CTNNB1 4489/4885WNT3A 3582/4885
US-20100035877-A1 METHODS AND COMPOSITIONS FOR TREATING PATHOLOGIES ASSOCIATED WITH BDNF SIGNALING NTRK2, NGF, BDNF FASN 3542/4885CTNNB1 2998/4885WNT3A 1236/4885

“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.