SCHEMBL6972027

SCHEMBL6972027

[CH2]Oc1noc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.51
MGLL Q99685 1/20 0.51
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
LMNA P02545 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
MAOB P27338 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
ACHE P22303 1/20 0.40
EPHX2 P34913 8/20 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
SCHEMBL8142563 0.79 FAAH (0.56) FAAHMGLLCA12CA1CA2
SCHEMBL10733456 0.79 FAAH (0.59) FAAHMGLLCA12CA1CA2
SCHEMBL9035692 0.76 FAAH (0.49) FAAHMGLLCA12CA1CA2
SCHEMBL7814843 0.75 FAAH (0.51) FAAHMGLLCA12CA1CA2
SCHEMBL8373116 0.75 FAAH (0.69) FAAHMGLLCA12CA1CA2
SCHEMBL7346703 0.75 FAAH (0.47) FAAHMGLLCA12CA1CA2
SCHEMBL6966345 0.73 ALDH1A1 (0.56) FAAHESR1ESR2SMN1; SMN2
SCHEMBL14775860 0.73 HIF1A (0.47) FAAHMGLLCA12CA1CA2
SCHEMBL25255597 0.72 FAAH (0.49) FAAHMGLLHIF1ASMN1; SMN2SSTR4
SCHEMBL10520166 0.72 FAAH (0.45) FAAHMGLLCA12CA1CA2

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-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP claimed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
EP-1304325-A1 5-(M-CYANOBENZYLAMINO)PYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-04-23 EP disclosed