SCHEMBL22248302

SCHEMBL22248302

NCC12CC1CN(CCc1ccc(-n3ccc(NC(=O)N4CCNCC4)nc3=O)cc1F)C2

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
USP28 Q96RU2 1/20 0.31
USP25 Q9UHP3 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
SCHEMBL22248361 0.89 ALK (0.32)
SCHEMBL22235972 0.89 F10 (0.31) F10
Hydrochloric Acid SCHEMBL30276472 0.88 F10 (0.31) F10
SCHEMBL22248310 0.88 KCNH2 (0.32)
SCHEMBL22248414 0.87 ROCK2 (0.33)
SCHEMBL22248283 0.86 FAAH (0.33)
SCHEMBL22249121 0.85 HTR2C (0.32) F10HTR2CHTR2BUSP28USP25
SCHEMBL22249122 0.84 ROCK2 (0.35)
SCHEMBL22248384 0.81 ROCK2 (0.33)
SCHEMBL22248300 0.81

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
WO-2020150372-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 WO disclosed