SCHEMBL4283428

SCHEMBL4283428

O=C(c1ccsc1)c1cc2ccncc2[nH]1.O=S(=O)(c1ccccc1)n1c(C(O)c2ccsc2)cc2ccncc21

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.39
MAP2K1 Q02750 1/20 0.36
NAMPT P43490 5/20 0.35
HRH4 Q9H3N8 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
RBP4 P02753 1/20 0.31
HDAC1 Q13547 1/20 0.30
TNKS O95271 1/20 0.30
HSD11B1 P28845 1/20 0.30

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
SCHEMBL4279643 0.86 RECQL (0.43) RECQLMAP2K1NAMPTHRH4ALDH1A1
SCHEMBL4275790 0.86 RECQL (0.50) RECQLNAMPTALDH1A1LMNAMAPT
SCHEMBL4274096 0.76 MAP2K1 (0.51) MAP2K1NAMPTHRH4RBP4HDAC1
SCHEMBL4271243 0.75 RECQL (0.57) RECQLNAMPTALDH1A1LMNAMAPT
SCHEMBL4276540 0.74 RECQL (0.56) RECQLNAMPTALDH1A1LMNAMAPT
SCHEMBL4266959 0.69 RECQL (0.50) RECQLNAMPTALDH1A1LMNAMAPT
SCHEMBL4272549 0.68 MAP2K1 (0.68) MAP2K1HRH4MAPTRBP4HDAC1
SCHEMBL20417734 0.66 RECQL (0.68) RECQLALDH1A1LMNAMAPTHDAC1
SCHEMBL4271447 0.66 DAO (0.41) HRH4MAPT
SCHEMBL4273734 0.65 MAPT (0.57) RECQLNAMPTALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7608627-B2 I kappa B kinase inhibition; diabetes; (7-Chloro-1H-pyrrolo[2,3-c]pyridin-2-yl)methanol; N-Benzyl-7-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-27 US disclosed
US-20080064715-A1 6-Azaindole Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-03-13 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 (1 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-20080064715-A1 6-Azaindole Compound RELA, NFKBIA, GPR119 RECQL 1543/4885MAP2K1 551/4885NAMPT 1272/4885

“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.