SCHEMBL3440802

SCHEMBL3440802

N#Cc1ccc(N)c(C#N)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 3/20 0.43
GAA P10253 2/20 0.43
IMPDH2 P12268 1/20 0.41
IMPDH1 P20839 1/20 0.41
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.40
STS P08842 1/20 0.40
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.38
CYP2A6 P11509 2/20 0.37
PRKACA P17612 2/20 0.37
PRKACG P22612 2/20 0.37
PRKACB P22694 2/20 0.37
CA12 O43570 1/20 0.37
CA2 P00918 1/20 0.37

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
SCHEMBL30702253 1.00 ALDH1A1 (0.43) ALDH1A1KDM4EGAAIMPDH2IMPDH1
Nitrogen SCHEMBL29003750 0.98 ALDH1A1 (0.42) ALDH1A1KDM4EGAAIMPDH2IMPDH1
SCHEMBL17672451 0.85 ALDH1A1 (0.40) ALDH1A1KDM4EGAAIMPDH2IMPDH1
SCHEMBL23302859 0.85 CYP1A2 (0.37) ALDH1A1KDM4EGAACYP1A2CYP3A4
SCHEMBL20915846 0.85 CYP1A2 (0.37) ALDH1A1KDM4EGAACYP1A2CYP3A4
SCHEMBL29188585 0.81 ALDH1A1 (0.41) ALDH1A1KDM4EGAAIMPDH2IMPDH1
SCHEMBL2419320 0.81 ALDH1A1 (0.47) ALDH1A1KDM4EGAAIMPDH2IMPDH1
SCHEMBL29443092 0.80 ALDH1A1 (0.50) ALDH1A1KDM4EGAAIMPDH2IMPDH1
SCHEMBL352155 0.80 ALDH1A1 (0.50) ALDH1A1KDM4EGAAIMPDH2IMPDH1
SCHEMBL11277214 0.80 ALDH1A1 (0.50) ALDH1A1KDM4EGAAIMPDH2IMPDH1

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 170 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115976677-B Method for preparing colored meta-aramid fiber by adopting reactive stock solution coloring technology 浙江桐昆新材料研究院有限公司 2023-12-22 CN claimed
CN-115976677-A Method for preparing colored meta-aramid by adopting reactive stock solution coloring technology 浙江桐昆新材料研究院有限公司 2023-04-18 CN claimed
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 CN claimed
WO-2024126619-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING A COMPOUND OF FORMULA (I) AND A COMPOUND OF FORMULA (II), AND DISPLAY DEVICE COMPRISING THE ORGANIC ELECTROLUMINESCENT DEVICE NOVALED GMBH (DE) 2024-06-20 WO disclosed
WO-2024061807-A1 ORGANIC ELECTRONIC DEVICE COMPRISING A CHARGE GENERATION LAYER NOVALED GMBH (DE) 2024-03-28 WO disclosed
WO-2024033322-A1 METAL COMPLEX, SEMICONDUCTOR LAYER COMPRISING A METAL COMPLEX AND ORGANIC ELECTRONIC DEVICE NOVALED GMBH (DE) 2024-02-15 WO disclosed
EP-4306613-A1 ORGANOMETALLIC COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND ELECTRONIC APPARATUS AND ELECTRONIC DEVICE INCLUDING THE LIGHT-EMITTING DEVICE Samsung Display Co., Ltd. (KR) 2024-01-17 EP disclosed
CN-115976677-B Method for preparing colored meta-aramid fiber by adopting reactive stock solution coloring technology 浙江桐昆新材料研究院有限公司 2023-12-22 CN disclosed
EP-4284147-A1 LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE SAME Samsung Display Co., Ltd. (KR) 2023-11-29 EP disclosed
EP-4274402-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME Samsung Display Co., Ltd. (KR) 2023-11-08 EP disclosed
EP-4210454-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME Samsung Display Co., Ltd. (KR) 2023-07-12 EP disclosed
US-3971771-A DYES FOR POLYESTERS CIBA-GEIGY AG (CH) 1976-07-27 US disclosed
US-3964862-A Process for dyeing and printing textile materials of synthetic organic fibers CIBA-GEIGY AG (CH) 1976-06-22 US disclosed
US-3963431-A POLYESTER CIBA-GEIGY AG (CH) 1976-06-15 US disclosed
US-3954398-A Polyester fibers dyed with a disazo disperse dyestuff CIBA-GEIGY AG (CH) 1976-05-04 US disclosed
US-3950321-A POLYESTERS BASF AKTIENGESELLSCHAFT (DT) 1976-04-13 US disclosed
US-3945991-A Heterocyclic azo compounds containing a quaternated hydrazide group CIBA-GEIGY AG (CH) 1976-03-23 US disclosed
US-3945989-A Fluoro triazine containing water insoluble azo dyestuff CIBA-GEIGY AG (CH) 1976-03-23 US disclosed
US-3943120-A WATER INSOLUBLE CIBA-GEIGY AG (CH) 1976-03-09 US disclosed
US-3933786-A Heterocyclic-azo-phenyl compounds containing a styrl group CIBA-GEIGY AG (CH) 1976-01-20 US disclosed