SCHEMBL19181981

SCHEMBL19181981

Nc1ccc(COCc2ccc(N)o2)o1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.33
POLB P06746 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL12503658 0.78
SCHEMBL31037931 0.76 HTT (0.35) POLBTDP1
SCHEMBL31037930 0.76 HTT (0.35) POLBTDP1
SCHEMBL18364673 0.75 CYP2A6 (0.43) ALOX5POLBTDP1
SCHEMBL20222495 0.72
SCHEMBL11984312 0.72
SCHEMBL16197726 0.70 CHRM2 (0.52) ALOX5POLBTDP1
SCHEMBL2889732 0.67
SCHEMBL16358412 0.67 NPC1 (0.31)
SCHEMBL19248455 0.67 TAAR1 (0.32) ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11066377-B2 Process for producing aromatic primary diamines RHODIA OPERATIONS (FR) 2021-07-20 US disclosed
US-10899726-B2 Process for producing aromatic primary diamines RHODIA OPERATIONS (FR) 2021-01-26 US disclosed
EP-3674285-A1 PROCESS FOR PRODUCING M-XYLYLENEDIAMINE RHODIA OPERATIONS (FR) 2020-07-01 EP disclosed
US-20200172501-A1 PROCESS FOR PRODUCING AROMATIC PRIMARY DIAMINES SPECIALTY OPERATIONS FRANCE (FR) 2020-06-04 US disclosed
EP-3166921-B1 PROCESS FOR PRODUCING AROMATIC PRIMARY DIAMINES RHODIA OPERATIONS (FR) 2020-02-19 EP disclosed
US-20170217916-A1 PROCESS FOR PRODUCING AROMATIC PRIMARY DIAMINES SPECIALTY OPERATIONS FRANCE (FR) 2017-08-03 US disclosed