SCHEMBL6033129

SCHEMBL6033129

N[C@H](CCCCNC(=O)C(F)(F)F)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.62
POLB P06746 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
CA3 P07451 2/20 0.55
CA5A P35218 2/20 0.55
CA5B Q9Y2D0 2/20 0.55
CA12 O43570 1/20 0.55
CA2 P00918 1/20 0.55
CA4 P22748 1/20 0.55
CA6 P23280 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
EPHX1 P07099 1/20 0.51
GSR P00390 1/20 0.48
OTC P00480 1/20 0.47
ARG2 P78540 4/20 0.44
ARG1 P05089 3/20 0.44

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
SCHEMBL875166 1.00 ALDH1A1 (0.62) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL1604188 1.00 ALDH1A1 (0.62) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL22679808 0.95 ALDH1A1 (0.59) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL31296029 0.95 ALDH1A1 (0.59) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL23728668 0.93 ALDH1A1 (0.57) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL23728666 0.93 ALDH1A1 (0.57) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL7322492 0.90 ALDH1A1 (0.50) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL29361453 0.83 GSR (0.46) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL26692311 0.83 OTC (0.49) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL21689955 0.83 GSR (0.48) GSROTCARG2ARG1DDAH1

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
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 EP disclosed
US-20240011979-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS INC. (KR) 2024-01-11 US disclosed
CN-116829949-A Compositions for detecting or measuring analytes 伯蒂斯有限公司 2023-09-29 CN disclosed
WO-2023075435-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE 주식회사 베르티스 2023-05-04 WO disclosed
US-20220283131-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS CO., LTD. (KR) 2022-09-08 US disclosed
WO-2022050529-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE ㈜베르티스 2022-03-10 WO disclosed
US-7053043-B1 Pharmaceutical compositions comprising synthetic peptide copolymers and methods for preventing and treating GVHD and HVGD YEDA RESEARCH AND DEVELOPMENT CO.LTD. (IL) 2006-05-30 US disclosed
EP-0871456-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING SYNTHETIC PEPTIDE COPOLYMER FOR PREVENTION OF GVHD YEDA RES & DEV (IL) 2003-02-12 EP disclosed
US-5858964-A IMMUNOSUPPRESSANT YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 1999-01-12 US disclosed