SCHEMBL11114472

SCHEMBL11114472

OCCCNc1ccccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 1/20 0.51
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
HSD17B10 Q99714 1/20 0.51
KDR P35968 1/20 0.48
LMNA P02545 1/20 0.47
CDC25A P30304 1/20 0.47
HTT P42858 1/20 0.47
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
RAD52 P43351 2/20 0.43
IDO1 P14902 1/20 0.43
POLB P06746 1/20 0.43
EBP Q15125 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
CYP19A1 P11511 1/20 0.42
KCNH3 Q9ULD8 1/20 0.41

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
SCHEMBL532717 0.88 RAD52 (0.51) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL9421891 0.83 MAPT (0.52) MAPTALDH1A1KDM4EHPGDTSHR
SCHEMBL24335155 0.82 MAPT (0.46) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL11118699 0.82 MAPT (0.44) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL9069882 0.80 NR4A2 (0.53) MAPTALDH1A1KDM4EHPGDHTT
SCHEMBL4165647 0.80 MEN1 (0.46) MAPTHPGDHTTMEN1KMT2A
SCHEMBL9615522 0.80 KAT2B (0.53) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL13446854 0.79 MAPT (0.48) MAPTALDH1A1KDM4EHPGDTSHR
Hydrochloric Acid SCHEMBL28958615 0.78 NR4A2 (0.51) MAPTALDH1A1KDM4EHPGDHTT
SCHEMBL10734735 0.78 TAAR1 (0.48) MAPTALDH1A1KDM4EGAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0058868-B1 DERIVATIVES OF TETRAHYDROPYRIMIDINON, PROCESS FOR THEIR PREPARATION AND HERBICIDES CONTAINING THOSE DERIVATIVES AS ACTIVE PRODUCTS NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1984-04-11 EP disclosed
US-4402731-A Herbicidally active novel substituted tetrahydropyrimidinones NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1983-09-06 US disclosed
EP-0058868-A1 Derivatives of tetrahydropyrimidinon, process for their preparation and herbicides containing those derivatives as active products NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1982-09-01 EP disclosed