SCHEMBL2028227

SCHEMBL2028227

O=Cc1ccc(-c2ccc(-c3cccs3)c3nsnc23)s1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.60
▸ CYP2A6 P11509 2/20 0.40
▸ CYP2E1 P05181 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2B6 P20813 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ ERN1 O75460 2/20 0.38
▸ EGFR P00533 1/20 0.37
▸ RET P07949 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ CTRC Q99895 1/20 0.37
▸ PRF1 P14222 1/20 0.36
▸ KDM4E B2RXH2 5/20 0.36
▸ MAPT P10636 4/20 0.36
▸ HPGD P15428 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ GAA P10253 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.35

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
SCHEMBL16532879 0.88 CYP2E1 (0.45) DPP4CYP2A6CYP2E1CYP3A4CYP2C9
SCHEMBL16533128 0.85 DPP4 (0.49) DPP4CYP2A6CYP2E1CYP3A4CYP2C9
SCHEMBL12587621 0.85 DPP4 (0.40) DPP4CYP2A6CYP2E1CYP3A4CYP2C9
SCHEMBL20610387 0.82 DPP4 (0.45) DPP4KDM4EMAPTHPGDMEN1
SCHEMBL41299 0.81 KDM4E (0.43) CYP2A6CYP2E1CYP3A4CYP2C9CYP2B6
SCHEMBL31111276 0.81 ERN1 (0.41) DPP4ERN1KDM4EMAPTHPGD
SCHEMBL14685994 0.80 DPP4 (0.46) DPP4CYP2A6CYP2E1CYP3A4CYP2C9
SCHEMBL28909433 0.79 CYP2E1 (0.39) DPP4CYP2A6CYP2E1CYP3A4CYP2C9
SCHEMBL10330347 0.79 ALDH1A1 (0.36) KDM4EMAPTHPGDMEN1KMT2A
SCHEMBL20428786 0.79 DPP4 (0.45) DPP4KDM4EMAPTHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993697-B2 Conducting and semiconducting organic materials Commonwealth Scientific and Industrial Research Institute Organisation (AU) 2015-03-31 — — US disclosed
US-8993697-B2 Conducting and semiconducting organic materials Commonwealth Scientific and Industrial Research Institute Organisation (AU) 2015-03-31 — — US disclosed
US-8993697-B2 Conducting and semiconducting organic materials Commonwealth Scientific and Industrial Research Institute Organisation (AU) 2015-03-31 — — US disclosed
US-20130289217-A1 CONDUCTING AND SEMICONDUCTING ORGANIC MATERIALS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2013-10-31 — — US disclosed
US-20130289217-A1 CONDUCTING AND SEMICONDUCTING ORGANIC MATERIALS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2013-10-31 — — US disclosed
US-20130289217-A1 CONDUCTING AND SEMICONDUCTING ORGANIC MATERIALS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2013-10-31 — — US disclosed
US-8501889-B2 Conducting and semiconducting organic materials COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2013-08-06 — — US disclosed
US-8501889-B2 Conducting and semiconducting organic materials COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2013-08-06 — — US disclosed
US-8501889-B2 Conducting and semiconducting organic materials COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2013-08-06 — — US disclosed
CN-102086308-B Novel dye dopant, composition comprising the same, and photovoltaic device comprising the same TAIWAN TEXTILE RES INST 2013-07-17 — — CN disclosed
EP-2333017-B1 A novel dye-dopant, a composition comprising the same and a photovoltaic device including such composition TAIWAN TEXTILE RES INST (CN) 2012-07-18 — — EP disclosed
EP-2333017-B1 A novel dye-dopant, a composition comprising the same and a photovoltaic device including such composition TAIWAN TEXTILE RES INST (CN) 2012-07-18 — — EP disclosed
US-20110166298-A1 CONDUCTING AND SEMICONDUCTING ORGANIC MATERIALS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL ORGANISATION (AU) 2011-07-07 — — US disclosed
US-20110166298-A1 CONDUCTING AND SEMICONDUCTING ORGANIC MATERIALS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL ORGANISATION (AU) 2011-07-07 — — US disclosed
US-20110166298-A1 CONDUCTING AND SEMICONDUCTING ORGANIC MATERIALS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL ORGANISATION (AU) 2011-07-07 — — US disclosed
EP-2333017-A1 A novel dye-dopant, a composition comprising the same and a photovoltaic device including such composition Taiwan Textile Research Institute (CN) 2011-06-15 — — EP disclosed
EP-2333017-A1 A novel dye-dopant, a composition comprising the same and a photovoltaic device including such composition Taiwan Textile Research Institute (CN) 2011-06-15 — — EP disclosed
CN-102086308-A Novel dye dopant, composition comprising the same, and photovoltaic device comprising the same TAIWAN TEXTILE RES INST 2011-06-08 — — CN disclosed
WO-2009155657-A1 CONDUCTING AND SEMICONDUCTING ORGANIC MATERIALS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2009-12-30 — — WO disclosed
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