SCHEMBL22476375

SCHEMBL22476375

CC1=CC=C(N)C(C)(C)C1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.31
NOS2 P35228 1/20 0.31

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 SCHEMBL6740936 0.75
SCHEMBL21066929 0.70
SCHEMBL8462314 0.68 ALDH1A1 (0.45)
SCHEMBL21542490 0.67
SCHEMBL1071743 0.65 NPC1 (0.30)
SCHEMBL21374484 0.65
Hydrochloric Acid SCHEMBL22499931 0.65 CYP3A4 (0.36)
SCHEMBL3191429 0.62
SCHEMBL13115437 0.60
SCHEMBL20809962 0.59

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-3715437-A1 COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2020-09-30 EP disclosed