SCHEMBL8849656

SCHEMBL8849656

Cc1n[nH]cc1Cc1c[nH]nc1C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.35
LMNA P02545 1/20 0.33
APEX1 P27695 1/20 0.33
PMP22 Q01453 1/20 0.33

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
SCHEMBL22083543 0.81 DAO (0.43)
SCHEMBL4704957 0.80
SCHEMBL932426 0.80
SCHEMBL7424636 0.80
SCHEMBL4054528 0.80
SCHEMBL21310404 0.78
Hydrochloric Acid SCHEMBL16585011 0.78
Hydrochloric Acid SCHEMBL20299016 0.78
SCHEMBL24774562 0.77
SCHEMBL22838146 0.77

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-0799168-A1 USE OF PYRAZOLE DERIVATIVES WITH HYDROPHOBIC GROUPS AS NITRIFICATION INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 1997-10-08 EP claimed
WO-1996020146-A1 USE OF PYRAZOLE DERIVATIVES WITH HYDROPHOBIC GROUPS AS NITRIFICATION INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 1996-07-04 WO claimed