SCHEMBL2139684

SCHEMBL2139684

CCc1cccc2sc(NN)nc12

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.62
MEN1 O00255 8/20 0.62
KMT2A Q03164 8/20 0.62
ALDH1A1 P00352 5/20 0.62
TDP1 Q9NUW8 4/20 0.62
KDM4E B2RXH2 4/20 0.62
PKM P14618 4/20 0.62
MAPK1 P28482 2/20 0.62
GAA P10253 8/20 0.59
LMNA P02545 4/20 0.59
HPGD P15428 2/20 0.59
IDO1 P14902 2/20 0.53
SMN1; SMN2 Q16637 3/20 0.49
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
POLB P06746 2/20 0.47
DYRK1A Q13627 2/20 0.43
PRNP P04156 1/20 0.42

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
SCHEMBL6220487 0.80 MEN1 (0.55) MAPTMEN1KMT2AALDH1A1TDP1
SCHEMBL201830 0.78 ALDH1A1 (0.61) MAPTMEN1KMT2AALDH1A1TDP1
SCHEMBL2138224 0.78 MEN1 (0.65) MAPTMEN1KMT2AALDH1A1TDP1
SCHEMBL2136477 0.77 MAPT (1.00) MAPTMEN1KMT2AALDH1A1TDP1
Hydrochloric Acid SCHEMBL28945336 0.77 MEN1 (0.63) MAPTMEN1KMT2AALDH1A1TDP1
SCHEMBL5537888 0.76 MEN1 (0.51) MAPTMEN1KMT2AALDH1A1TDP1
SCHEMBL11834129 0.76 MEN1 (0.51) MAPTMEN1KMT2AALDH1A1TDP1
SCHEMBL12109857 0.76 MEN1 (0.51) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL11315752 0.75 MEN1 (0.48) MAPTMEN1KMT2AALDH1A1TDP1
SCHEMBL5537891 0.75 MEN1 (0.54) MAPTMEN1KMT2AALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242278-B2 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-14 US disclosed
US-20120101278-A1 PROCESS FOR PRODUCING BIARYL COMPOUND HAGIYA KOJI (JP) 2012-04-26 US disclosed
EP-1473286-B1 PROCESS FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL CO (JP) 2009-11-04 EP disclosed
US-20090216017-A1 PROCESS FOR PRODUCING BIARYL COMPOUND HAGIYA KOJI 2009-08-27 US disclosed
US-7554000-B2 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-30 US disclosed
CN-1303043-C Process for producing biaryl compound SUMITOMO CHEMICAL CO (JP) 2007-03-07 CN disclosed
CN-1642879-A Process for preparing diaryl compounds SUMITOMO CHEMICAL CO (JP) 2005-07-20 CN disclosed
US-20050096471-A1 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-05-05 US disclosed
EP-1473286-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2004-11-03 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120101278-A1 PROCESS FOR PRODUCING BIARYL COMPOUND PPOX, CAT, TYR MAPT 3403/4885MEN1 3325/4885KMT2A 575/4885
US-20090216017-A1 PROCESS FOR PRODUCING BIARYL COMPOUND PPOX, CAT, TYR MAPT 3403/4885MEN1 3325/4885KMT2A 575/4885
US-20050096471-A1 Process for producing biaryl compound PPOX, CAT, TYR MAPT 3403/4885MEN1 3325/4885KMT2A 575/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.