SCHEMBL12830102

SCHEMBL12830102

CCc1ccc(-c2c(O)c(/C(C)=N/NC(=S)Nc3ccc(C=O)cc3)nn2C)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.41
MAOB P27338 4/20 0.41
MAPT P10636 5/20 0.38
ALDH1A1 P00352 5/20 0.38
QPCT Q16769 1/20 0.35
HPGD P15428 3/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX12 P18054 1/20 0.33
RAB9A P51151 3/20 0.33
KDM4E B2RXH2 1/20 0.33
KDR P35968 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL12830098 0.93 MAOA (0.36) MAOAMAOBMAPTALDH1A1HPGD
SCHEMBL12830088 0.91 KMT2A (0.35) MAOAMAOBMAPTALDH1A1HPGD
SCHEMBL12829599 0.90 MAOA (0.34) MAOAMAOBMAPTALDH1A1HPGD
SCHEMBL14224195 0.89 ALDH1A1 (0.41) MAOAMAOBMAPTALDH1A1QPCT
SCHEMBL12829968 0.87 MAPT (0.39) MAOAMAOBMAPTALDH1A1HPGD
SCHEMBL12829591 0.87 ALDH1A1 (0.41) MAOAMAOBMAPTALDH1A1HPGD
SCHEMBL1484366 0.87 ALDH1A1 (0.43) MAOAMAOBMAPTALDH1A1HPGD
SCHEMBL1484367 0.87 ALDH1A1 (0.43) MAOAMAOBMAPTALDH1A1HPGD
SCHEMBL12755618 0.87 ALDH1A1 (0.43) MAOAMAOBMAPTALDH1A1HPGD
SCHEMBL13747809 0.86 BCHE (0.38) MAPTALDH1A1HPGDGAASMN1; SMN2

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
US-8318796-B2 Heterocyclic compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-11-27 US disclosed
US-20110077290-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES LIMITED (JP) 2011-03-31 US disclosed
US-7576115-B2 Heterocyclic compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-08-18 US disclosed
US-20080027068-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES LIMITED (JP) 2008-01-31 US 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 (2 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-20110077290-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NR2C2, ROR1, NR0B2 MAOA 1498/4885MAOB 1230/4885MAPT 3117/4885
US-20080027068-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NR2C2, ROR1, NR0B2 MAOA 1467/4885MAOB 1205/4885MAPT 2880/4885

“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.