SCHEMBL1128732

SCHEMBL1128732

O=CNc1cc(Cl)ccc1Oc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.66
L3MBTL1 Q9Y468 11/20 0.56
LMNA P02545 5/20 0.56
NPSR1 Q6W5P4 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.55
MAPT P10636 2/20 0.55
CYP1A2 P05177 2/20 0.53
CYP3A4 P08684 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
MAPK1 P28482 2/20 0.52
TP53 P04637 1/20 0.52
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
POLB P06746 1/20 0.51
HTT P42858 1/20 0.49
ALDH1A1 P00352 1/20 0.48
THRB P10828 1/20 0.48
CCR2 P41597 1/20 0.47

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
SCHEMBL10288373 0.85 IRAK4 (0.47) TSHRL3MBTL1LMNANPSR1SMN1; SMN2
SCHEMBL3521281 0.81 TSHR (0.66) TSHRL3MBTL1LMNANPSR1CYP1A2
SCHEMBL12165506 0.80 TSHR (0.52) TSHRL3MBTL1LMNANPSR1SMN1; SMN2
SCHEMBL4414857 0.80 TSHR (1.00) TSHRL3MBTL1LMNASMN1; SMN2MAPT
SCHEMBL31090837 0.79 CCR2 (0.68) TSHRL3MBTL1LMNANPSR1SMN1; SMN2
SCHEMBL1758548 0.77 KMT2A (0.57) TSHRL3MBTL1LMNANPSR1SMN1; SMN2
SCHEMBL8787198 0.76 L3MBTL1 (0.64) L3MBTL1LMNANPSR1SMN1; SMN2MAPT
SCHEMBL23418697 0.76 LMNA (0.62) L3MBTL1LMNANPSR1SMN1; SMN2MAPT
SCHEMBL30933708 0.76 LMNA (0.62) L3MBTL1LMNANPSR1SMN1; SMN2MAPT
SCHEMBL21305526 0.75 PNLIP (0.54) TSHRPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US disclosed
EP-2283020-A1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI Pharmaceuticals, Inc. (US) 2011-02-16 EP disclosed
US-7737136-B2 Non-steroidal progesterone receptor modulators N.V. ORGANON (NL) 2010-06-15 US disclosed
US-7737136-B2 Non-steroidal progesterone receptor modulators N.V. ORGANON (NL) 2010-06-15 US disclosed
US-7737136-B2 Non-steroidal progesterone receptor modulators N.V. ORGANON (NL) 2010-06-15 US disclosed
WO-2009143051-A1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-26 WO disclosed
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-19 US disclosed
EP-1495030-B1 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS ORGANON NV (NL) 2008-08-13 EP disclosed
EP-1495030-B1 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS ORGANON NV (NL) 2008-08-13 EP disclosed
CN-1279044-C Non-steroidal progesterone receptor modulators AKZO NOBEL NV (NL) 2006-10-11 CN disclosed
US-20050171087-A1 Non-steroidal progesterone receptor modulators MERCK SHARP & DOHME B.V. (NL) 2005-08-04 US disclosed
CN-1649879-A Non-steroidal progesterone receptor modulators AKZO NOBEL NV (NL) 2005-08-03 CN disclosed
EP-1495030-A1 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS Akzo Nobel N.V. (NL) 2005-01-12 EP disclosed
WO-2003084963-A1 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS AKZO NOBEL N.V. (NL) 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 (2 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-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES ABL1, TPMT, CYP2C19 TSHR 902/4885L3MBTL1 4613/4885LMNA 3418/4885
US-20050171087-A1 Non-steroidal progesterone receptor modulators PGR, PGRMC1, PGRMC2 TSHR 200/4885L3MBTL1 4849/4885LMNA 4247/4885

“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.