SCHEMBL8923934

SCHEMBL8923934

c1cncc(C2NCCS2)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 7/20 0.56
CHRNA4 P43681 7/20 0.56
CHRNA7 P36544 5/20 0.51
MAPT P10636 3/20 0.50
CYP2A6 P11509 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 2/20 0.50
CYP2D6 P10635 2/20 0.50
CYP2C19 P33261 2/20 0.50
KMT2A Q03164 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP11B2 P19099 1/20 0.43
CHRNA3 P32297 1/20 0.43

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
Formamide SCHEMBL9819793 0.90 CHRNB2 (0.46) CHRNB2CHRNA4CHRNA7MAPTCYP2A6
SCHEMBL4153725 0.78 MAPT (0.61) CHRNB2CHRNA4CHRNA7MAPTSMN1; SMN2
Heptylformamide SCHEMBL9819900 0.78 MAPT (0.43) CHRNB2CHRNA4CHRNA7MAPTALDH1A1
SCHEMBL4655299 0.77 MAPT (0.66) MAPTSMN1; SMN2CYP2D6CYP2C19TDP1
SCHEMBL2335474 0.75 CHRNB2 (0.59) CHRNB2CHRNA4CHRNA7CYP2A6SMN1; SMN2
SCHEMBL9370773 0.72 KDM4E (0.50) CHRNB2CHRNA4CHRNA7CYP2A6SMN1; SMN2
Hydrochloric Acid SCHEMBL2436158 0.72 MAOA (0.48) CHRNB2CHRNA4CHRNA7CYP2A6SMN1; SMN2
SCHEMBL159642 0.72 CHRNB2 (1.00) CHRNB2CHRNA4CHRNA7CYP2A6SMN1; SMN2
Bicarbonate SCHEMBL9826841 0.71 MAPT (0.58) MAPTSMN1; SMN2TDP1ALDH1A1KDM4E
SCHEMBL27467551 0.71

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
CN-1058780-A Has the active thiazolidine carboxylic acid amides derivative of anti-allergy, their preparation and application SANKYO CO (JP) 1992-02-19 CN claimed
JP-9249565-A None JP disclosed
JP-5051381-A None JP disclosed
CN-1265648-A Conjugaes of dithiocarbamates with pharmacologically active agents and uses therefor MEDINOX INC (US) 2000-09-06 CN disclosed
JP-H09249565-A THIAZOLIDINE HAVING ANTI-HIV ACTIVITY NIPPON SUISAN KAISHA LTD 1997-09-22 JP disclosed
JP-H0551381-A THIAZOLIDINE DERIVATIVE TAISHO PHARMACEUT CO LTD 1993-03-02 JP disclosed
CN-1058780-A Has the active thiazolidine carboxylic acid amides derivative of anti-allergy, their preparation and application SANKYO CO (JP) 1992-02-19 CN disclosed