SCHEMBL10690359

SCHEMBL10690359

NCN1c2ccccc2Sc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.63
KDM1A O60341 5/20 0.53
PTGS1 P23219 3/20 0.53
PTGS2 P35354 2/20 0.53
MAOA P21397 1/20 0.52
LMNA P02545 4/20 0.52
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
CYP2D6 P10635 3/20 0.50
SLC22A1 O15245 2/20 0.50
PRNP P04156 2/20 0.50
CYP1A2 P05177 2/20 0.50
CHRM2 P08172 2/20 0.50
CHRM4 P08173 2/20 0.50
HTR1A P08908 2/20 0.50
CHRM5 P08912 2/20 0.50
ADRA2A P08913 2/20 0.50
CHRM1 P11229 2/20 0.50
DRD2 P14416 2/20 0.50
ADRA2B P18089 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
SCHEMBL2921645 0.83 PIM1 (0.76) PIM1KDM1AMAOALMNAKMT2A
Iodide SCHEMBL31634400 0.81 PIM1 (0.73) PIM1KDM1AMAOALMNAKMT2A
Iodide SCHEMBL31634399 0.81 PIM1 (0.73) PIM1KDM1AMAOALMNAKMT2A
Hydrochloric Acid SCHEMBL14697550 0.81 PIM1 (0.73) PIM1KDM1AMAOALMNAKMT2A
SCHEMBL1649654 0.79 PIM1 (0.89) PIM1KDM1ALMNAKMT2AMEN1
SCHEMBL29557425 0.77 KDM1A (0.61) PIM1KDM1APTGS1PTGS2MAOA
SCHEMBL293951 0.77 KDM1A (0.61) PIM1KDM1APTGS1PTGS2MAOA
SCHEMBL9077379 0.77 PTGS1 (0.58) PIM1KDM1APTGS1PTGS2MAOA
SCHEMBL1581710 0.77 KDM1A (0.53) PIM1KDM1APTGS1PTGS2MAOA
SCHEMBL208025 0.76 PIM1 (0.79) PIM1KDM1ALMNAKMT2AMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0265520-A1 MODIFIED ASPHALT COMPOSITIONS The Lubrizol Corporation (US) 1988-05-04 EP disclosed
WO-1987006947-A1 MODIFIED ASPHALT COMPOSITIONS THE LUBRIZOL CORPORATION (US) 1987-11-19 WO disclosed
US-4677146-A Modified asphalt compositions comprising a nitrogen derivative of an esterified copolymer THE LUBRIZOL CORPORATION (US) 1987-06-30 US disclosed
US-3933761-A INTERPOLYMERS THE LUBRIZOL CORPORATION (US) 1976-01-20 US disclosed