SCHEMBL13660641

SCHEMBL13660641

O=C(NCc1ccco1)C1Cc2ccnc(Cl)c2N1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
HPGD P15428 2/20 0.51
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
POLB P06746 3/20 0.45
TDP1 Q9NUW8 3/20 0.45
APEX1 P27695 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
CYP2C19 P33261 1/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 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
SCHEMBL13660713 0.76 LMNA (0.40) ALDH1A1HPGDLMNASMN1; SMN2KMT2A
SCHEMBL5119694 0.68 TDP1 (0.66) ALDH1A1HPGDSMN1; SMN2KMT2AMEN1
SCHEMBL4473275 0.68 ALDH1A1 (0.60) ALDH1A1HPGDKMT2AMEN1L3MBTL1
SCHEMBL5123195 0.67 TDP1 (0.69) ALDH1A1HPGDLMNASMN1; SMN2KMT2A
SCHEMBL13660643 0.67 DPP4 (0.38) ALDH1A1HPGDTSHRMAPK1CYP2C19
SCHEMBL5190400 0.67 KMT2A (0.54) ALDH1A1HPGDKMT2AMEN1L3MBTL1
Hydrochloric Acid SCHEMBL21640577 0.67 ALDH1A1 (0.58) ALDH1A1HPGDKMT2AMEN1L3MBTL1
SCHEMBL5124500 0.65 TDP1 (0.66) ALDH1A1HPGDSMN1; SMN2KMT2AMEN1
SCHEMBL18977797 0.65 TDP1 (0.62) ALDH1A1HPGDLMNASMN1; SMN2KMT2A
SCHEMBL13660483 0.65 DPP4 (0.37) ALDH1A1HPGDHSD17B10

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 ALDH1A1 3508/4885HPGD 3042/4885LMNA 3936/4885

“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.