SCHEMBL660111

SCHEMBL660111

O=C(NNC(=O)c1cccs1)C1=CN(CC(=O)c2cccs2)C=CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 5/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
TP53 P04637 1/20 0.43
ERCC5 P28715 1/20 0.42
FEN1 P39748 1/20 0.42
GAA P10253 3/20 0.41
NPC1 O15118 3/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL661687 0.98 ERCC5 (0.43) RAB9AMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL27871718 0.93 ERCC5 (0.43) RAB9AMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL661571 0.91 RAB9A (0.52) RAB9AMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL7799733 0.91 ALDH1A1 (0.42) RAB9AMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL286969 0.88 ALDH1A1 (0.42) RAB9AMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL287219 0.87 TSHR (0.42) RAB9AMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL287773 0.87 ALDH1A1 (0.39) RAB9AMEN1KMT2AALDH1A1ERCC5
SCHEMBL659705 0.86 ALDH1A1 (0.37) RAB9AMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL287147 0.86 KMT2A (0.57) RAB9AMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL661019 0.85 NPSR1 (0.43) RAB9AMEN1KMT2AALDH1A1L3MBTL1

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-20120046317-A1 NOVEL HETEROCYCLIC COMPOUNDS DUTT CHAITANYA (IN) 2012-02-23 US claimed
US-20120046317-A1 NOVEL HETEROCYCLIC COMPOUNDS DUTT CHAITANYA (IN) 2012-02-23 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-20120046317-A1 NOVEL HETEROCYCLIC COMPOUNDS AGER, REN, AGT RAB9A 2179/4885MEN1 1455/4885KMT2A 4512/4885

“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.