SCHEMBL19370663

SCHEMBL19370663

CN(CCNCc1cccc(C(=O)C(C)(C)O)c1)Cc1cccc(C(=O)C(C)(C)O)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 11/20 0.41
▸ TMEM97 Q5BJF2 10/20 0.41
▸ UNG P13051 1/20 0.38
▸ MEP1B Q16820 1/20 0.38
▸ NR1H4 Q96RI1 1/20 0.38
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SMN1; SMN2 Q16637 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
SCHEMBL14700290 0.87 SMN1; SMN2 (0.43) SIGMAR1TMEM97MEN1KMT2ASMN1; SMN2
SCHEMBL15197916 0.83 MEP1B (0.48) UNGMEP1BNR1H4MEN1KMT2A
SCHEMBL14700247 0.82 PDCD1 (0.46) UNGMEP1BNR1H4CA1CA2
SCHEMBL14700304 0.77 MEP1B (0.44) MEP1BMEN1KMT2A
SCHEMBL14700308 0.77 PTPN1 (0.49) MEP1BMEN1KMT2A
SCHEMBL15197897 0.76 NR1H4 (0.46) MEP1BNR1H4
SCHEMBL14700261 0.74 ALDH1A1 (0.47) MEP1BMEN1KMT2ASMN1; SMN2
SCHEMBL14700268 0.74 RORC (0.45) MEP1B
SCHEMBL14700278 0.74 MEN1 (0.48) MEP1BMEN1KMT2ASMN1; SMN2
SCHEMBL14700329 0.73 PTPN1 (0.56) MEP1BMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2557072-B1 PARA- OR MESO-FUNCTIONALIZED AROMATIC KETONE COMPOUNDS, PREPARATION METHODS THEREOF, AND PHOTOPOLYMERIZATION INITIATORS COMPRISING THE SAME SHENZHEN UV-CHEMTECH CO LTD (CN) 2017-09-20 — — EP disclosed
Send feedback