SCHEMBL9682306

SCHEMBL9682306

C=C(C)C(=O)NC(C)(N)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.34
TGFBR1 P36897 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PIK3CD O00329 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL6232122 0.78 PIK3CD (0.45) RXFP1TGFBR1TDP1PIK3CDALDH1A1
SCHEMBL7709808 0.78 TDP1 (0.39) RXFP1TGFBR1TDP1ALDH1A1
SCHEMBL25685612 0.76 RXFP1 (0.37) RXFP1TGFBR1TDP1ALDH1A1
Hydrochloric Acid SCHEMBL11184246 0.76 TDP1 (0.38) TGFBR1TDP1ALDH1A1
SCHEMBL28032433 0.76 TDP1 (0.38) TGFBR1TDP1ALDH1A1
SCHEMBL15019990 0.75 RXFP1 (0.34) RXFP1TGFBR1TDP1PIK3CDALDH1A1
SCHEMBL902120 0.75 PIK3CD (0.35) PIK3CD
Hydrochloric Acid SCHEMBL5871680 0.74 TDP1 (0.36) TGFBR1TDP1ALDH1A1
SCHEMBL8389085 0.73 TSHR (0.36) PIK3CD
SCHEMBL21332619 0.72 RXFP1 (0.35) RXFP1TGFBR1ALDH1A1

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
US-5141717-A Carbon monitor containing anion exchange resin IONICS, INCORPORATED (US) 1992-08-25 US disclosed