Sugi Predict

Sugi Predict / Compounds / SCHEMBL5014969

SCHEMBL5014969

SCHEMBL5014969

O=C(O)CNCC(O)CNCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC22A6 Q4U2R8 1/20 0.41
▸ LMNA P02545 3/20 0.35
▸ LDHA P00338 1/20 0.35
▸ SRR Q9GZT4 1/20 0.35
▸ ALKBH5 Q6P6C2 1/20 0.35
▸ SUCNR1 Q9BXA5 1/20 0.35
▸ EGLN1 Q9GZT9 1/20 0.35
▸ TET2 Q6N021 3/20 0.35
▸ GABRR1 P24046 2/20 0.35
▸ KDM4A O75164 2/20 0.35
▸ KDM4C Q9H3R0 2/20 0.35
▸ KDM2A Q9Y2K7 2/20 0.35
▸ TET3 O43151 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ ADRB2 P07550 1/20 0.33
▸ ADRB1 P08588 1/20 0.33

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
SCHEMBL5014975 0.89 CYP1A2 (0.36) SLC22A6LMNAALKBH5SUCNR1EGLN1
SCHEMBL983155 0.87 LMNA (0.36) SLC22A6LMNATET2GABRR1KDM4A
SCHEMBL14393150 0.87 SLC22A6 (0.32) SLC22A6LMNAALKBH5SUCNR1EGLN1
SCHEMBL2553608 0.85 MME (0.37) SLC22A6LMNAEGLN1ALDH1A1MAPT
SCHEMBL8447231 0.85 MAPT (0.35) SLC22A6LMNATET2GABRR1KDM4A
SCHEMBL986003 0.84 PTPN1 (0.40) SLC22A6TET2KDM4AKDM4CKDM2A
SCHEMBL27898394 0.83 LMNA (0.35) SLC22A6LMNALDHASRRALKBH5
SCHEMBL94152 0.83 — —
SCHEMBL6695805 0.82 GABRR1 (0.37) SLC22A6LMNATET2GABRR1KDM4A
Hydrochloric Acid SCHEMBL10681763 0.81 TET2 (0.33) SLC22A6LMNALDHASRRALKBH5

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
EP-2013344-B1 ANTISENSE AGENTS COMBINING STRONGLY BOUND BASE - MODIFIED OLIGONUCLEOTIDE AND ARTIFICIAL NUCLEASE BALTIC TECHNOLOGY DEV LTD (EE) 2012-08-29 — — EP disclosed
US-20080115423-A1 Polishing Composition For Silicon Wafer NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2008-05-22 — — US disclosed
US-4338460-A Process for preparing chelating agents W. R. GRACE & CO. (US) 1982-07-06 — — US disclosed
US-4225502-A CHELATING AGENTS W. R. GRACE & CO. (US) 1980-09-30 — — US disclosed
US-4152345-A FOR USE IN PLATING BATHS, HORTICULTURE, STAIN REMOVAL W. R. GRACE & CO. (US) 1979-05-01 — — US disclosed
US-4069249-A CHELATING AGENTS W. R. GRACE & CO. (US) 1978-01-17 — — US disclosed
US-4059548-A Hexahydropyrimidine-1,3-diacetonitriles and processes for preparing the same W. R. GRACE & CO. (US) 1977-11-22 — — US disclosed
US-4059548-A Hexahydropyrimidine-1,3-diacetonitriles and processes for preparing the same W. R. GRACE & CO. (US) 1977-11-22 — — US disclosed
US-4058528-A 5-Hydroxyhexahydropyrimidine W. R. GRACE & CO. (US) 1977-11-15 — — US disclosed
US-4058528-A 5-Hydroxyhexahydropyrimidine W. R. GRACE & CO. (US) 1977-11-15 — — US disclosed
US-4058527-A Preparation of N,N'-Dicarboxymethyl-1,3-propanediamines W. R. GRACE & CO. (US) 1977-11-15 — — US disclosed
US-4058527-A Preparation of N,N'-Dicarboxymethyl-1,3-propanediamines W. R. GRACE & CO. (US) 1977-11-15 — — US disclosed
US-3988367-A Preparation of N,N'-dicarboxymethyl-1,3-propanediamines W. R. GRACE & CO. (US) 1976-10-26 — — US disclosed
US-3988367-A Preparation of N,N'-dicarboxymethyl-1,3-propanediamines W. R. GRACE & CO. (US) 1976-10-26 — — US disclosed