SCHEMBL17375989

SCHEMBL17375989

CC1CCC(C)(N)CC1N

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL7546450 0.81 ALDH1A1 (0.37) ALDH1A1TDP1
SCHEMBL466049 0.80 ALDH1A1 (0.39) ALDH1A1TDP1
SCHEMBL12245492 0.78 FUCA1 (0.31)
Methylamine SCHEMBL7555450 0.78 FUCA1 (0.31)
Hydrochloric Acid SCHEMBL2377228 0.76 FUCA1 (0.30)
SCHEMBL27418565 0.74
SCHEMBL763905 0.74 TRPA1 (0.32)
SCHEMBL12245486 0.73
SCHEMBL17500908 0.72
SCHEMBL4168216 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3356324-A1 METHOD FOR PRODUCING ISOCYANATES Covestro Deutschland AG (DE) 2018-08-08 EP disclosed
EP-3313565-A1 PROCESS FOR PREPARING POLYISOCYANATES Covestro Deutschland AG (DE) 2018-05-02 EP disclosed
EP-3313815-A1 PROCESS FOR PROVIDING HYDROGEN CHLORIDE FOR CHEMICAL REACTIONS Covestro Deutschland AG (DE) 2018-05-02 EP disclosed
EP-3160630-A1 METHODS FOR PRODUCING CHEMICAL PRODUCTS WITH OPERATION INTERRUPTIONS Covestro Deutschland AG (DE) 2017-05-03 EP disclosed
WO-2017001320-A1 PROCESS FOR PROVIDING HYDROGEN CHLORIDE FOR CHEMICAL REACTIONS COVESTRO DEUTSCHLAND AG (DE) 2017-01-05 WO disclosed
WO-2017001322-A1 PROCESS FOR PREPARING POLYISOCYANATES COVESTRO DEUTSCHLAND AG (DE) 2017-01-05 WO disclosed
WO-2015197522-A1 METHODS FOR PRODUCING CHEMICAL PRODUCTS WITH OPERATION INTERRUPTIONS COVESTRO DEUTSCHLAND AG (DE) 2015-12-30 WO disclosed