SCHEMBL5452460

SCHEMBL5452460

CCCCNC(=S)Nc1ccccn1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.69
HTT P42858 2/20 0.69
ALDH1A1 P00352 5/20 0.68
ALOX12 P18054 4/20 0.68
KDM4E B2RXH2 2/20 0.68
POLB P06746 1/20 0.68
RAB9A P51151 2/20 0.65
QPCT Q16769 1/20 0.60
NPSR1 Q6W5P4 2/20 0.52
ACHE P22303 1/20 0.52
NPC1 O15118 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51
LMNA P02545 2/20 0.50

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
SCHEMBL11488553 0.91 ALDH1A1 (0.71) SMN1; SMN2HTTALDH1A1ALOX12KDM4E
SCHEMBL4402140 0.84 ALDH1A1 (0.63) SMN1; SMN2HTTALDH1A1ALOX12KDM4E
SCHEMBL14093828 0.84 ALDH1A1 (0.66) SMN1; SMN2HTTALDH1A1ALOX12KDM4E
SCHEMBL31349696 0.84 ALDH1A1 (0.66) SMN1; SMN2HTTALDH1A1ALOX12KDM4E
SCHEMBL31349697 0.84 ALDH1A1 (0.66) SMN1; SMN2HTTALDH1A1ALOX12KDM4E
SCHEMBL19822471 0.83 POLB (0.69) SMN1; SMN2HTTALDH1A1ALOX12KDM4E
SCHEMBL11839412 0.83 ALDH1A1 (0.70) SMN1; SMN2ALDH1A1ALOX12KDM4EPOLB
SCHEMBL5739547 0.82 ALDH1A1 (0.66) SMN1; SMN2HTTALDH1A1ALOX12KDM4E
Hydrochloric Acid SCHEMBL11837771 0.81 ALDH1A1 (0.68) SMN1; SMN2ALDH1A1ALOX12KDM4EPOLB
SCHEMBL6957793 0.80 ALDH1A1 (0.76) SMN1; SMN2HTTALDH1A1ALOX12KDM4E

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-20070040151-A1 Two-component initiator system (amine-free) with very good storage stability and particular suitability for acid systems HERAEUS KULZER GMBH (DE) 2007-02-22 US disclosed