SCHEMBL11098147

SCHEMBL11098147

Cc1ccccc1/C=N/OCl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
TSHR P16473 2/20 0.45
KDM4E B2RXH2 6/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 6/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
HTT P42858 2/20 0.40
MAPK1 P28482 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
GAA P10253 1/20 0.36
ACHE P22303 1/20 0.36
POLB P06746 2/20 0.35
RECQL P46063 2/20 0.35
MPI P34949 1/20 0.35
CYP1A2 P05177 2/20 0.35

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
SCHEMBL11098150 1.00 ALDH1A1 (0.45) ALDH1A1TSHRKDM4ELMNASMN1; SMN2
SCHEMBL6076526 0.81 ALDH1A1 (0.46) ALDH1A1TSHRKDM4ELMNASMN1; SMN2
SCHEMBL12763871 0.81 ALDH1A1 (0.46) ALDH1A1TSHRKDM4ELMNASMN1; SMN2
SCHEMBL6076524 0.81 ALDH1A1 (0.46) ALDH1A1TSHRKDM4ELMNASMN1; SMN2
SCHEMBL28618300 0.77 ALDH1A1 (0.50) ALDH1A1KDM4ELMNASMN1; SMN2MEN1
SCHEMBL13468052 0.76 ALDH1A1 (0.42) ALDH1A1TSHRKDM4ELMNASMN1; SMN2
SCHEMBL12764020 0.76 SMN1; SMN2 (0.48) ALDH1A1TSHRKDM4ELMNASMN1; SMN2
SCHEMBL28613057 0.75 SMN1; SMN2 (0.41) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL13044358 0.73 ALDH1A1 (0.50) ALDH1A1TSHRKDM4ELMNASMN1; SMN2
SCHEMBL16773866 0.73 SMN1; SMN2 (0.40) ALDH1A1TSHRKDM4ELMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0013111-B1 3'-(SUBSTITUTED PHENYL)-SPIRO(ISOBENZOFURAN-1(3H),5'(4'H)-ISOXAZOL)-3-ONES, PROCESS FOR THEIR PREPARATION, THEIR USE AS HERBICIDES AND PLANT GROWTH REGULANTS AND THEIR APPLICATION TO THE PREPARATION OF ISOXAZOLE DERIVATIVES MONSANTO COMPANY (US) 1984-02-22 EP disclosed
US-4401457-A 3'-(Substituted phenyl)-spiro[isobenzofuran-1(3H),5'(4'H)-isoxazol]-3-ones and their use as herbicides MONSANTO COMPANY (US) 1983-08-30 US disclosed
US-4364768-A FOR LEGUMES MONSANTO COMPANY (US) 1982-12-21 US disclosed
EP-0013111-A2 3'-(substituted phenyl)-spiro(isobenzofuran-1(3H),5'(4'H)-isoxazol)-3-ones, process for their preparation, their use as herbicides and plant growth regulants and their application to the preparation of isoxazole derivatives MONSANTO COMPANY (US) 1980-07-09 EP disclosed
US-4209629-A HERBICIDES, PLANT GROWTH REGULATORS MONSANTO COMPANY (US) 1980-06-24 US disclosed