SCHEMBL9035692

SCHEMBL9035692

c1ccc(Oc2noc3ccccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.49
MGLL Q99685 1/20 0.49
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
LMNA P02545 2/20 0.43
HTT P42858 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.42
ACHE P22303 1/20 0.42
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
MAPT P10636 1/20 0.41
LTA4H P09960 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 2/20 0.41
EPHX2 P34913 4/20 0.40
RAB9A P51151 2/20 0.40
HIF1A Q16665 1/20 0.39

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
SCHEMBL2444781 0.82 ACHE (0.42) CA12CA1CA2CA9ACHE
SCHEMBL2441052 0.76 FAAH (0.42) FAAHMGLLCA12CA1CA2
SCHEMBL6972027 0.76 FAAH (0.51) FAAHMGLLCA12CA1CA2
SCHEMBL8142563 0.76 FAAH (0.56) FAAHMGLLCA12CA1CA2
SCHEMBL14775860 0.74 HIF1A (0.47) FAAHMGLLCA12CA1CA2
SCHEMBL7814843 0.72 FAAH (0.51) FAAHMGLLCA12CA1CA2
SCHEMBL10733456 0.72 FAAH (0.59) FAAHMGLLCA12CA1CA2
SCHEMBL8373116 0.72 FAAH (0.69) FAAHMGLLCA12CA1CA2
SCHEMBL7346703 0.72 FAAH (0.47) FAAHMGLLCA12CA1CA2
SCHEMBL7257058 0.72 MAPT (0.44) CA12CA1CA2CA9LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0442655-B1 Benzisoxazole derivatives ZENECA LTD (GB) 1996-01-17 EP disclosed
US-5176737-A BENZISOXAZOLE COMPOUNDS USEFUL AS HERBICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-01-05 US disclosed
EP-0442655-A2 Benzisoxazole derivatives ZENECA LIMITED (GB) 1991-08-21 EP disclosed
US-4571255-A Subsituted phenoxybenzisoxazole herbicides PPG INDUSTRIES, INC. (US) 1986-02-18 US disclosed
US-4571255-A Subsituted phenoxybenzisoxazole herbicides PPG INDUSTRIES, INC. (US) 1986-02-18 US disclosed
US-4571255-A Subsituted phenoxybenzisoxazole herbicides PPG INDUSTRIES, INC. (US) 1986-02-18 US disclosed