SCHEMBL1835068

SCHEMBL1835068

O=C(Nc1ccccc1)Oc1ccccc1-c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ KDM4E B2RXH2 1/20 0.56
▸ BLM P54132 1/20 0.56
▸ CHRNB2 P17787 1/20 0.53
▸ CHRNB4 P30926 1/20 0.53
▸ CHRNA3 P32297 1/20 0.53
▸ CHRNA4 P43681 1/20 0.53
▸ HSP90AA1 P07900 1/20 0.52
▸ ALDH1A1 P00352 3/20 0.50
▸ HTT P42858 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ FAAH O00519 1/20 0.50
▸ ATM Q13315 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ FABP7 O15540 1/20 0.48
▸ FABP3 P05413 1/20 0.48
▸ FABP5 Q01469 1/20 0.48
▸ RAB9A P51151 1/20 0.46

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
SCHEMBL9124256 0.83 KMT2A (0.54) GAAKMT2AKDM4EBLMHSP90AA1
SCHEMBL3078254 0.81 FABP3 (0.49) KDM4EALDH1A1HTTSMN1; SMN2MAPT
SCHEMBL1839851 0.80 ALDH1A1 (0.44) KMT2AKDM4EALDH1A1SMN1; SMN2FAAH
SCHEMBL1837770 0.79 CHRM3 (0.47) KMT2AKDM4EALDH1A1SMN1; SMN2MEN1
SCHEMBL1639323 0.77 FABP3 (0.56) KDM4EALDH1A1HTTSMN1; SMN2MAPT
SCHEMBL1638833 0.77 FABP3 (0.56) GAAKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL28487364 0.77 FABP3 (0.56) KDM4EALDH1A1HTTSMN1; SMN2FABP7
SCHEMBL30563023 0.77 FABP3 (0.56) KDM4EALDH1A1HTTSMN1; SMN2MAPT
SCHEMBL24282083 0.77 KDM4E (0.59) GAAKMT2AKDM4EBLMHSP90AA1
SCHEMBL8048675 0.77 NOTUM (0.59) GAAKMT2AKDM4EBLMHSP90AA1

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-2322504-A1 PROCESS FOR THE PREPARATION OF N-SUBSTITUTED CARBAMIC ACID ESTER AND PROCESS FOR THE PREPARATION OF ISOCYANATE USING THE N-SUBSTITUTED CARBAMIC ACID ESTER Asahi Kasei Chemicals Corporation (JP) 2011-05-18 — — EP disclosed
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