SCHEMBL13182960

SCHEMBL13182960

COCCCNC(=O)c1cncc(C)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.59
▸ ATM Q13315 2/20 0.55
▸ KDM4E B2RXH2 5/20 0.54
▸ GAA P10253 2/20 0.54
▸ POLB P06746 1/20 0.54
▸ CYP1A2 P05177 2/20 0.52
▸ CYP3A4 P08684 2/20 0.52
▸ CYP2C19 P33261 2/20 0.52
▸ HPGD P15428 3/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ MAPT P10636 1/20 0.49
▸ LMNA P02545 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ HCAR2 Q8TDS4 1/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ ALOX12 P18054 1/20 0.47

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
SCHEMBL16132011 0.91 ATM (0.58) ALDH1A1ATMKDM4EGAAPOLB
SCHEMBL8403022 0.91 ALDH1A1 (0.67) ALDH1A1ATMKDM4EGAAPOLB
SCHEMBL13778300 0.85 KDM4E (0.56) ALDH1A1ATMKDM4EGAAPOLB
SCHEMBL13852632 0.81 HCAR2 (0.53) ALDH1A1ATMKDM4EGAAPOLB
SCHEMBL13852610 0.81 HCAR2 (0.53) ALDH1A1ATMKDM4EGAAPOLB
SCHEMBL13778271 0.81 KDM4E (0.52) ALDH1A1ATMKDM4EGAAPOLB
SCHEMBL13116579 0.81 HPGD (0.55) ALDH1A1ATMKDM4EGAAPOLB
SCHEMBL16133036 0.79 KDM4E (0.54) ALDH1A1ATMKDM4EGAAPOLB
SCHEMBL5426126 0.78 HCAR2 (0.56) ALDH1A1ATMKDM4EGAAPOLB
SCHEMBL13778268 0.78 SMN1; SMN2 (0.51) ALDH1A1ATMKDM4EGAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1628957-B1 SULFOPYRROLES TAKEDA PHARMACEUTICAL (JP) 2010-09-29 — — EP disclosed
US-7612064-B2 Sulfopyrroles TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-03 — — US disclosed
US-7612064-B2 Sulfopyrroles TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-03 — — US disclosed
US-20070060570-A1 Sulfopyrroles TALEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-15 — — US disclosed
US-20070060570-A1 Sulfopyrroles TALEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-15 — — 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-20070060570-A1 Sulfopyrroles TYK2, ARSA, SULT2A1 ALDH1A1 1078/4885ATM 2211/4885KDM4E 3031/4885

“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.

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