SCHEMBL1503147

SCHEMBL1503147

COC(=O)c1ncc(COc2ccc(F)c(Cl)c2)c2c1OC(C)(C)OC2

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
SCN9A Q15858 7/20 0.35
SCN5A Q14524 2/20 0.35
MAOB P27338 3/20 0.34
PPARG P37231 2/20 0.34
MAOA P21397 1/20 0.34
NR1H4 Q96RI1 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA1A P35348 1/20 0.33

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
SCHEMBL4306506 0.92 ALDH1A1 (0.39) ALDH1A1MAPK1KMT2ASCN9ASCN5A
SCHEMBL22738226 0.91 SCN9A (0.38) ALDH1A1MAPK1KMT2ASCN9ASCN5A
SCHEMBL30193078 0.87 KMT2A (0.40) ALDH1A1MAPK1KMT2AMAOB
SCHEMBL1503189 0.87 KMT2A (0.40) ALDH1A1MAPK1KMT2AMAOB
SCHEMBL22719950 0.82 MAOB (0.39) ALDH1A1MAPK1KMT2AMAOB
SCHEMBL2146871 0.80 MAPT (0.38) ALDH1A1KMT2AMAOBHTR1AADRA1A
SCHEMBL2147119 0.79 ALDH1A1 (0.36) ALDH1A1MAPK1KMT2AMAOB
SCHEMBL24065373 0.78 MAPK1 (0.41) MAPK1PPARG
SCHEMBL12398991 0.78 KMT2A (0.48) ALDH1A1MAPK1KMT2AMAOB
SCHEMBL22719944 0.78 HDAC1 (0.36) ALDH1A1MAPK1KMT2AMAOBPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8742123-B2 HIV integrase inhibitors from pyridoxine TAIMED BIOLOGICS, INC. (TW) 2014-06-03 US claimed
US-20110178120-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE AMBRILIA BIOPHARMA, INC. (CA) 2011-07-21 US claimed
EP-3687538-B1 METHODS OF TREATING ELEVATED PLASMA CHOLESTEROL MONTREAL HEART INST (CA) 2024-04-17 EP disclosed
US-11931348-B2 Methods of treating elevated plasma cholesterol Montréal Heart Institute (CA) 2024-03-19 US disclosed
US-20230088095-A1 METHODS OF TREATING ELEVATED PLASMA CHOLESTEROL Montréal Heart Institute (CA) 2023-03-23 US disclosed
US-11400082-B2 Methods of treating elevated plasma cholesterol Montréal Heart Institute (CA) 2022-08-02 US disclosed
US-20210369688-A1 METHODS OF TREATING ELEVATED PLASMA CHOLESTEROL MONTREAL HEART INSTITUTE (CA) 2021-12-02 US disclosed
EP-3687538-A1 METHODS OF TREATING ELEVATED PLASMA CHOLESTEROL Montreal Heart Institute (CA) 2020-08-05 EP disclosed
US-8742123-B2 HIV integrase inhibitors from pyridoxine TAIMED BIOLOGICS, INC. (TW) 2014-06-03 US disclosed
US-8742123-B2 HIV integrase inhibitors from pyridoxine TAIMED BIOLOGICS, INC. (TW) 2014-06-03 US disclosed
US-8742123-B2 HIV integrase inhibitors from pyridoxine TAIMED BIOLOGICS, INC. (TW) 2014-06-03 US disclosed
US-20110178120-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE AMBRILIA BIOPHARMA, INC. (CA) 2011-07-21 US disclosed
US-20110178120-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE AMBRILIA BIOPHARMA, INC. (CA) 2011-07-21 US disclosed
US-20110178120-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE AMBRILIA BIOPHARMA, INC. (CA) 2011-07-21 US disclosed
EP-2300433-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE Ambrilia Biopharma Inc. (CA) 2011-03-30 EP disclosed
WO-2009146555-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE AMBRILIA BIOPHARMA INC. (CA) 2009-12-10 WO disclosed
WO-2009146555-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE AMBRILIA BIOPHARMA INC. (CA) 2009-12-10 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-20210369688-A1 METHODS OF TREATING ELEVATED PLASMA CHOLESTEROL CETP, LDLR, APOB ALDH1A1 568/4885MAPK1 2839/4885KMT2A 4239/4885
US-20110178120-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE PNPO, CCNB1, BLVRB ALDH1A1 334/4885MAPK1 1638/4885KMT2A 1953/4885
US-11931348-B2 Methods of treating elevated plasma cholesterol CETP, LDLR, APOB ALDH1A1 568/4885MAPK1 2839/4885KMT2A 4239/4885
US-20230088095-A1 METHODS OF TREATING ELEVATED PLASMA CHOLESTEROL CETP, LDLR, APOB ALDH1A1 568/4885MAPK1 2839/4885KMT2A 4239/4885
US-11400082-B2 Methods of treating elevated plasma cholesterol CETP, LDLR, APOB ALDH1A1 568/4885MAPK1 2839/4885KMT2A 4239/4885

“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.