SCHEMBL10706623

SCHEMBL10706623

c1ccc2cc(-c3nnco3)ccc2c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 12/20 0.60
▸ TLR8 Q9NR97 1/20 0.57
▸ ALDH1A1 P00352 3/20 0.51
▸ HPGD P15428 2/20 0.51
▸ CYP1A2 P05177 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ HSD17B10 Q99714 2/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ CYP11B1 P15538 1/20 0.50
▸ CYP11B2 P19099 1/20 0.50
▸ MEN1 O00255 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ KMT2A Q03164 1/20 0.49

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
SCHEMBL3970760 0.81 NOTUM (0.78) NOTUMTLR8ALDH1A1KDM4ETSHR
SCHEMBL21795694 0.78 NOTUM (0.75) NOTUMTLR8ALDH1A1HPGDKDM4E
SCHEMBL17694561 0.77 NOTUM (0.78) NOTUMTLR8ALDH1A1HPGDKDM4E
SCHEMBL5571187 0.76 NOTUM (0.91) NOTUMTLR8ALDH1A1KDM4ETSHR
SCHEMBL9195816 0.76 SMN1; SMN2 (0.79) NOTUMALDH1A1HPGDCYP1A2SMN1; SMN2
SCHEMBL9555 0.76 NOTUM (1.00) NOTUMTLR8ALDH1A1SMN1; SMN2KDM4E
SCHEMBL11232897 0.76 NOTUM (0.74) NOTUMTLR8ALDH1A1HPGDKDM4E
SCHEMBL2610163 0.75 NOTUM (0.75) NOTUMTLR8ALDH1A1HPGDKDM4E
Biphenyl SCHEMBL22577775 0.74 NOTUM (0.95) NOTUMTLR8ALDH1A1SMN1; SMN2KDM4E
SCHEMBL32691830 0.73 KDM4E (0.50) NOTUMALDH1A1HPGDKDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1919842-A Oxdiazole derivative and application thereof in electroluminescent material UNIV EAST CHINA SCIENCE & TECH (CN) 2007-02-28 — — CN claimed
CN-108136756-A Laminated body, the manufacturing method of laminated body, the manufacturing method of semiconductor devices and semiconductor devices 富士胶片株式会社 2018-06-08 — — CN disclosed
CN-102627636-B Preparation method for naphthyl substituted rhodamine B oxadiazole compound and application thereof UNIV TIANJIN NORMAL 2014-07-30 — — CN disclosed
CN-102627636-A Preparation method for naphthyl substituted rhodamine B oxadiazole compound and application thereof UNIV TIANJIN NORMAL 2012-08-08 — — CN disclosed
CN-100465168-C Oxdiazole derivative and application thereof in electroluminescent material UNIV EAST CHINA SCIENCE & TECH (CN) 2009-03-04 — — CN disclosed
CN-1919842-A Oxdiazole derivative and application thereof in electroluminescent material UNIV EAST CHINA SCIENCE & TECH (CN) 2007-02-28 — — CN disclosed
EP-0137228-B1 PHOTOPOLYMERIZABLE COMPOSITION FUJI PHOTO FILM CO., LTD. (JP) 1988-10-05 — — EP disclosed
US-4113938-A OPTICAL BRIGHTENERS CIBA-GEIGY CORPORATION (US) 1978-09-12 — — US disclosed
US-4113937-A OPTICAL BRIGHTENERS CIBA-GEIGY CORPORATION (US) 1978-09-12 — — US disclosed
Send feedback