SCHEMBL8829720

SCHEMBL8829720

CCCCN=c1sc(C)cn1CCCC

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 1/20 0.34
TYR P14679 1/20 0.34
KCNA3 P22001 1/20 0.31
PDE4D Q08499 1/20 0.30
PDE7A Q13946 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
SCHEMBL8829719 1.00 ALDH1A1 (0.40) ALDH1A1CYP1A2CYP2C19POLBKMT2A
SCHEMBL8829792 0.79 CNR2 (0.39) ALDH1A1CYP1A2CYP2C19KMT2ALMNA
SCHEMBL8829791 0.79 CNR2 (0.39) ALDH1A1CYP1A2CYP2C19KMT2ALMNA
SCHEMBL8829688 0.75 MAPT (0.44) ALDH1A1POLBKMT2APDE4DPDE7A
SCHEMBL8829692 0.75 MAPT (0.44) ALDH1A1POLBKMT2APDE4DPDE7A
SCHEMBL964513 0.72 POLB (0.39) ALDH1A1POLBKMT2ALMNATYR
SCHEMBL28043879 0.67 ALDH1A1 (0.43) ALDH1A1CYP1A2CYP2C19POLBKMT2A
SCHEMBL14305754 0.61 CYP19A1 (0.43) ALDH1A1POLBKMT2ALMNATYR
SCHEMBL4342786 0.60 ALDH1A1 (0.50) ALDH1A1POLBKMT2ALMNATYR
SCHEMBL15442929 0.57 PKM (0.42) ALDH1A1KMT2ALMNA

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-5463069-A Process of producing 2-iminothiazoline derivatives and process of producing their intermediates SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-10-31 US claimed
US-5684196-A N-SUBSTITUTED-N-ARYLCYANAMIDE SUMITOMO CHEMICAL CO., LTD. (JP) 1997-11-04 US disclosed
US-5648533-A Process of producing 2-iminothiazoline derivatives and process of producing their intermediates SUMITOMO CHEMICAL CO., LTD. (JP) 1997-07-15 US disclosed
EP-0600489-B1 Process for producing 2-iminothiazoline derivatives and process for producing their intermediates SUMITOMO CHEMICAL CO (JP) 1996-11-06 EP disclosed
US-5463069-A Process of producing 2-iminothiazoline derivatives and process of producing their intermediates SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-10-31 US disclosed
EP-0600489-A1 Process for producing 2-iminothiazoline derivatives and process for producing their intermediates SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-06-08 EP disclosed