SCHEMBL10596808

SCHEMBL10596808

O=c1oc(-c2ccc(OC(F)(F)C(F)F)cc2)nc2cccc(F)c12

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.44
MAPT P10636 4/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 4/20 0.40
PBRM1 Q86U86 1/20 0.38
F7 P08709 1/20 0.37
F3 P13726 1/20 0.37
C1R P00736 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
TRPV4 Q9HBA0 1/20 0.37

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
SCHEMBL10967915 0.89 NOTUM (0.47) ELANEMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL10344654 0.89 ALDH1A1 (0.46) ELANEMAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL10594950 0.87 PBRM1 (0.53) ELANEMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL10344503 0.87 ELANE (0.47) ELANEMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL10596810 0.85 ELANE (0.43) ELANEMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL17554151 0.82 KDM4E (0.64) ELANEMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL11002682 0.80 F7 (0.53) ELANEMAPTNPC1RAB9APBRM1
SCHEMBL10344530 0.80 MAPT (0.54) ELANEMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL203587 0.78 ELANE (0.61) ELANEMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL10595299 0.78 ALDH1A1 (0.49) ELANEMAPTSMN1; SMN2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0136646-B1 PROCESS FOR THE PREPARATION OF 5-FLUOR-4H-3,1-BENZOXAZIN-4-ONES BASF Aktiengesellschaft (DE) 1989-01-25 EP disclosed
US-4562254-A Preparation of 5-fluoro-2-phenyl-4H-3,1-benzoxazin-4-ones BASF AKTIENGESELLSCHAFT (DE) 1985-12-31 US disclosed