SCHEMBL8619929

SCHEMBL8619929

CCCCCCCCCCCCCCCC(CN)CCCCCCCCCCCCCC

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.64
TDP1 Q9NUW8 1/20 0.64
LMNA P02545 1/20 0.56
OPRM1 P35372 1/20 0.48
DNM1 Q05193 8/20 0.48
TSHR P16473 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
EPHX1 P07099 1/20 0.48
THRB P10828 1/20 0.44

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
SCHEMBL10383392 1.00 ALDH1A1 (0.64) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL11042224 1.00 ALDH1A1 (0.64) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL20495959 1.00 ALDH1A1 (0.64) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL14436836 1.00 ALDH1A1 (0.64) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL24684882 1.00 ALDH1A1 (0.64) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL22658086 1.00 ALDH1A1 (0.64) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL24200454 1.00 ALDH1A1 (0.64) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL22342116 1.00 ALDH1A1 (0.64) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL22766465 1.00 ALDH1A1 (0.64) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL20495968 1.00 ALDH1A1 (0.64) ALDH1A1TDP1LMNAOPRM1DNM1

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
US-5760091-A ADDING TO SEAWATER SYSTEM AN AMINE COMPOUND AND A POLYAMINE COMPOUND KATAYAMA CHEMICAL, INC. (JP) 1998-06-02 US claimed
US-5760091-A ADDING TO SEAWATER SYSTEM AN AMINE COMPOUND AND A POLYAMINE COMPOUND KATAYAMA CHEMICAL, INC. (JP) 1998-06-02 US disclosed