SCHEMBL6991849

SCHEMBL6991849

CC1=C(N)Nc2cc(C(N)C3CCc4ccccc43)ccc2O1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.30

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
Hydrochloric Acid SCHEMBL6996287 0.99 SIGMAR1 (0.31) SIGMAR1
SCHEMBL7091666 0.94 PFKFB3 (0.33)
Hydrochloric Acid SCHEMBL6989617 0.93 IDO1 (0.33)
SCHEMBL7001764 0.81
Hydrochloric Acid SCHEMBL6998759 0.80
SCHEMBL7000036 0.74 NR3C1 (0.33)
SCHEMBL6991856 0.73 PRMT5 (0.43)
Hydrochloric Acid SCHEMBL6996290 0.72 PRMT5 (0.43)
Hydrochloric Acid SCHEMBL7001640 0.71 ALOX5 (0.31)
Hydrochloric Acid SCHEMBL6996294 0.69 IDO1 (0.33)

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-1015437-B1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THEIR USE IN PHARMACEUTICALS SCHERING AG (DE) 2003-12-03 EP claimed