SCHEMBL10284530

SCHEMBL10284530

Cn1c(-c2ccnc(F)c2)nc2cc(C(F)(F)F)cnc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.44
POLB P06746 1/20 0.43
S1PR1 P21453 1/20 0.41
MAPK14 Q16539 2/20 0.38
MAP4K4 O95819 1/20 0.36
MINK1 Q8N4C8 1/20 0.36
TNIK Q9UKE5 1/20 0.36
MAPK1 P28482 1/20 0.35
GRIN1 Q05586 2/20 0.35
GRIN2B Q13224 2/20 0.35
KIT P10721 2/20 0.35
GRM2 Q14416 1/20 0.34
MAPT P10636 1/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
USP2 O75604 1/20 0.33

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
SCHEMBL355251 0.86 POLB (0.46) POLBGRIN1GRIN2BKITMAPT
SCHEMBL10284671 0.84 POLB (0.43) POLBMAPK14GRIN1GRIN2BKIT
SCHEMBL10248995 0.84 SYK (0.41) SYKMAPK14MAP4K4MINK1TNIK
SCHEMBL10284409 0.82 POLB (0.42) POLB
SCHEMBL10284676 0.82 POLB (0.40) POLBGRIN1GRIN2BKITALDH1A1
SCHEMBL31141582 0.81 POLB (0.48) POLBGRIN1GRIN2BGRM2ALDH1A1
SCHEMBL169462 0.81 SYK (0.47) SYKS1PR1MAPK14KITCYP3A4
SCHEMBL28695285 0.80 CYP11B2 (0.52) POLBGRIN1GRIN2BKITALDH1A1
SCHEMBL23016976 0.79 SYK (0.40) SYKS1PR1MAPK14MAP4K4MINK1
SCHEMBL18498666 0.78 POLB (0.43) SYKPOLBALDH1A1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2424856-B1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2014-12-31 EP disclosed
US-8461181-B2 Fused heterocyclic compound and use thereof SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2013-06-11 US disclosed
US-8273764-B2 Fused heterocyclic compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-25 US disclosed
US-20120178779-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED 2012-07-12 US disclosed
US-20120015975-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 US disclosed
WO-2010125985-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-04 WO 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-20120178779-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF C3AR1, C9, C5 SYK 3145/4885POLB 4724/4885S1PR1 2765/4885
US-20120015975-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF C3AR1, C9, C5 SYK 3145/4885POLB 4724/4885S1PR1 2765/4885

“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.