SCHEMBL4270068

SCHEMBL4270068

O=C(Nc1ccccn1)c1cc2ccnc(Cl)c2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.52
NPC1 O15118 7/20 0.51
RAB9A P51151 7/20 0.51
ALOX15 P16050 1/20 0.51
SMN1; SMN2 Q16637 4/20 0.48
KCNMA1 Q12791 1/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
S1PR1 P21453 1/20 0.46
S1PR3 Q99500 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
CNR2 P34972 1/20 0.46

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
SCHEMBL4278472 0.85 NSD2 (0.59) NPC1RAB9AALOX15SMN1; SMN2TP53
SCHEMBL26095519 0.80 NSD2 (0.67) GRM5NPC1RAB9AALOX15SMN1; SMN2
SCHEMBL4278310 0.80 RHEB (0.53) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL4275837 0.80 KMT2A (0.48) KCNMA1KMT2AMEN1KDM4E
SCHEMBL4267853 0.78 PTPN11 (0.61) NPC1RAB9AALOX15SMN1; SMN2KCNMA1
SCHEMBL11610153 0.78 ALOX15 (0.61) GRM5NPC1RAB9AALOX15SMN1; SMN2
SCHEMBL30220550 0.75 ALOX15 (0.54) ALOX15TP53
SCHEMBL4073035 0.75 HPGD (0.49) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1
SCHEMBL4271295 0.75 KMT2A (0.52) NPC1RAB9AALOX15KMT2AMEN1
SCHEMBL25581554 0.74 RXFP1 (0.40) KMT2AMEN1ALDH1A1TP53

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
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-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-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
US-20080064715-A1 6-Azaindole Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-03-13 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 GRM5 2610/4885NPC1 2621/4885RAB9A 449/4885

“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.