SCHEMBL2759025

SCHEMBL2759025

OCCN(CCO)c1ccc(C(c2ccccc2)c2ccc(Cl)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
LMNA P02545 1/20 0.62
TP53 P04637 1/20 0.62
ATM Q13315 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62
MAPT P10636 3/20 0.49
MEN1 O00255 1/20 0.49
GAA P10253 1/20 0.45
PKM P14618 1/20 0.45
HTT P42858 1/20 0.45
MCL1 Q07820 1/20 0.45
CYP19A1 P11511 3/20 0.40
SLC6A2 P23975 3/20 0.40
SLC6A4 P31645 3/20 0.40
IDO1 P14902 2/20 0.39
TDO2 P48775 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
SLC6A3 Q01959 1/20 0.38
ABCB11 O95342 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
SCHEMBL2759083 0.93 KMT2A (0.69) KMT2ASMN1; SMN2LMNATP53ATM
SCHEMBL2759053 0.84 LMNA (0.59) KMT2ASMN1; SMN2LMNATP53ATM
SCHEMBL3893912 0.84 KMT2A (0.56) KMT2ASMN1; SMN2LMNATP53ATM
SCHEMBL1234089 0.82 KMT2A (0.57) KMT2ASMN1; SMN2LMNATP53ATM
SCHEMBL2759006 0.82 KMT2A (0.57) KMT2ASMN1; SMN2LMNATP53ATM
SCHEMBL2759017 0.81 KMT2A (0.59) KMT2ASMN1; SMN2LMNATP53ATM
SCHEMBL3273448 0.78 AOC3 (0.47) KMT2ASMN1; SMN2LMNATP53ATM
SCHEMBL2759021 0.77 KMT2A (1.00) KMT2ASMN1; SMN2LMNATP53ATM
SCHEMBL2759015 0.77 SMN1; SMN2 (0.51) KMT2ASMN1; SMN2LMNATP53ATM
SCHEMBL673181 0.76 CYP19A1 (0.59) LMNACYP19A1SLC6A2SLC6A4IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9828332-B2 Non-peptide BDNF neurotrophin mimetics PharmatorophiX, Inc. (US) 2017-11-28 US disclosed
US-9828332-B2 Non-peptide BDNF neurotrophin mimetics PharmatorophiX, Inc. (US) 2017-11-28 US disclosed
US-9828330-B2 Non-peptide BDNF neurotrophin mimetics PHARMATROPHIX, INC. (US) 2017-11-28 US disclosed
US-9828330-B2 Non-peptide BDNF neurotrophin mimetics PHARMATROPHIX, INC. (US) 2017-11-28 US disclosed
US-20160046559-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS PHARMATROPHIX, INC. (US) 2016-02-18 US disclosed
US-20160046559-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS PHARMATROPHIX, INC. (US) 2016-02-18 US disclosed
US-20160023990-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS PHARMATROPHIX, INC. 2016-01-28 US disclosed
US-20160023990-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS PHARMATROPHIX, INC. 2016-01-28 US disclosed
US-20140296343-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS PHARMATROPHIX, INC. 2014-10-02 US disclosed
US-20140296343-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS PHARMATROPHIX, INC. 2014-10-02 US disclosed
US-20120004310-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS PHARMATROPHIX, INC. 2012-01-05 US disclosed
US-20120004310-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS PHARMATROPHIX, INC. 2012-01-05 US disclosed
WO-2011150347-A2 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS PHARMATROPHIX (US) 2011-12-01 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 (4 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-20160023990-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS BDNF, NTRK2, NGF KMT2A 3890/4885SMN1; SMN2 34/4885LMNA 3046/4885
US-20120004310-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS BDNF, NTRK2, NGF KMT2A 3890/4885SMN1; SMN2 34/4885LMNA 3046/4885
US-20160046559-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS NTRK2, BDNF, NTRK1 KMT2A 3852/4885SMN1; SMN2 47/4885LMNA 2805/4885
US-20140296343-A1 NON-PEPTIDE BDNF NEUROTROPHIN MIMETICS BDNF, NTRK2, NGF KMT2A 3890/4885SMN1; SMN2 34/4885LMNA 3046/4885

“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.