SCHEMBL5110176

SCHEMBL5110176

Cc1cccc(-n2cc(C)cn2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPK1 P28482 1/20 0.46
RXRA P19793 5/20 0.44
GRIN1 Q05586 5/20 0.44
GRIN2B Q13224 5/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
PAX8 Q06710 1/20 0.44
KAT6A Q92794 1/20 0.43
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 2/20 0.43
HPGD P15428 2/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
ALPG P10696 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL22632940 0.84 KMT2A (0.47) NPSR1KDM4ERXRAGRIN1GRIN2B
SCHEMBL3422378 0.84 RXRA (0.48) NPSR1MAPTRXRAGRIN1GRIN2B
SCHEMBL9134471 0.84 NOTUM (0.47) L3MBTL1NPSR1MAPTKDM4EMAPK1
SCHEMBL29431786 0.84 EPHX2 (0.49) L3MBTL1NPSR1MAPTKDM4EMAPK1
SCHEMBL26031073 0.84 RXRA (0.48) NPSR1MAPTRXRAGRIN1GRIN2B
SCHEMBL23403693 0.84 GAA (0.62) NPSR1MAPTRXRAGRIN1GRIN2B
SCHEMBL3143610 0.84 NPC1 (0.50) L3MBTL1NPSR1MAPTKDM4EMAPK1
SCHEMBL22725123 0.84 EPHX2 (0.49) L3MBTL1NPSR1MAPTKDM4EMAPK1
SCHEMBL14330837 0.82 ALDH1A1 (0.52) KDM4EMAPK1RXRAGRIN1GRIN2B
SCHEMBL255496 0.82 GAA (0.59) L3MBTL1NPSR1MAPTKDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7332233-B2 Iridium compound and organic electroluminescent device using the same SAMSUNG SDI CO., LTD. (KR) 2008-02-19 US disclosed
US-7332233-B2 Iridium compound and organic electroluminescent device using the same SAMSUNG SDI CO., LTD. (KR) 2008-02-19 US disclosed
US-7332233-B2 Iridium compound and organic electroluminescent device using the same SAMSUNG SDI CO., LTD. (KR) 2008-02-19 US disclosed
US-20050031903-A1 Iridium compound and organic electroluminescent device using the same SAMSUNG DISPLAY CO., LTD. (KR) 2005-02-10 US disclosed
CN-1154637-C Method for producing substituted pyrazoles �����ɷ� 2004-06-23 CN disclosed
EP-1021416-B1 METHOD FOR PRODUCING SUBSTITUTED PYRAZOLES BASF AG (DE) 2004-05-19 EP disclosed
US-6229022-B1 REACTING CARBONYL COMPOUNDS WITH HYDRAZINE, ITS HYDRATE OR SALTS IN THE PRESENCE OF SULFURIC ACID AND IODINE OR AN IODINE LIBERATING COMPOUND BASF AKTIENGESELLSCHAFT (DE) 2001-05-08 US disclosed
EP-1021416-A1 METHOD FOR PRODUCING SUBSTITUTED PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 2000-07-26 EP disclosed
CN-1261351-A Process for preparing substituted pyrazoles BASF AG (DE) 2000-07-26 CN disclosed
WO-1998058914-A1 METHOD FOR PRODUCING SUBSTITUTED PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 1998-12-30 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-20050031903-A1 Iridium compound and organic electroluminescent device using the same IK, ALPL, PPIP5K2 L3MBTL1 2773/4885NPSR1 4669/4885MAPT 261/4885

“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.