SCHEMBL6503760

SCHEMBL6503760

Cc1nn(-c2cc(F)c(C#N)cc2F)c(C)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.40
SLC34A1 Q06495 7/20 0.37
TRPV4 Q9HBA0 1/20 0.37
ALDH1A1 P00352 1/20 0.36
KHK P50053 1/20 0.36
POLB P06746 3/20 0.35
MAPT P10636 1/20 0.35
EGLN2 Q96KS0 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL9563165 0.79 AR (0.56) ARSLC34A1POLBMEN1KMT2A
SCHEMBL6498014 0.78 AR (0.35) ARSLC34A1
SCHEMBL10431315 0.78 L3MBTL1 (0.41) TRPV4ALDH1A1POLBMAPTMEN1
SCHEMBL9309391 0.76 MAPT (0.47) ALDH1A1MAPTMEN1KMT2A
SCHEMBL6494499 0.75 KDM4E (0.59) SLC34A1TRPV4ALDH1A1MAPT
SCHEMBL6500898 0.74 SLC34A1 (0.36) SLC34A1TRPV4ALDH1A1POLBMAPT
SCHEMBL6498066 0.74 PDE4B (0.52) SLC34A1ALDH1A1
SCHEMBL9663236 0.74 POLB (0.39) ARSLC34A1POLBMAPTMEN1
SCHEMBL6506928 0.70 TRPV4 (0.36) ARTRPV4ALDH1A1EGLN2
SCHEMBL5844583 0.70 KDM4E (0.40) ARTRPV4ALDH1A1KHKEGLN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6906006-B1 N-arly-substituted nitrogen-containing heterocycles, processes and novel intermediates for their preparation, and their use as herbicides and plant growth regulators BAYER AKTIENGESELLSCHAFT (DE) 2005-06-14 US disclosed
US-5554580-A N-aryl-substituted nitrogen-containing heterocycles intermediates and their use as herbicides and plant growth regulators BAYER AKTIENGESELLSCHAFT (DE) 1996-09-10 US disclosed
EP-0370332-B1 N-aryl-nitrogen heterocycles, process and intermediates for their production and their use as herbicides and in controlling the growth of plants BAYER AG (DE) 1994-03-30 EP disclosed
US-5006148-A N-aryl-substituted nitrogen-containing heterocycles, and their use as herbicides and plant growth regulators BAYER AKTIENGESELLSCHAFT (DE) 1991-04-09 US disclosed
EP-0370332-A1 N-aryl-nitrogen heterocycles, process and intermediates for their production and their use as herbicides and in controlling the growth of plants BAYER AG (DE) 1990-05-30 EP disclosed