SCHEMBL4530472

SCHEMBL4530472

Cc1ccc(N(Cl)c2cncc(C(=O)N3CCSC3)c2)cn1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 4/20 0.39
ABL1 P00519 3/20 0.37
BCR P11274 3/20 0.37
GRM5 P41594 4/20 0.37
HPGD P15428 4/20 0.36
PKM P14618 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL4528127 0.77 GRM5 (0.58) GRM5MEN1KMT2AALDH1A1HSD17B10
SCHEMBL4529142 0.73 GRM5 (0.47) GRM5ALDH1A1
SCHEMBL5909238 0.71 HPGD (0.64) GABRA5ABL1BCRGRM5HPGD
SCHEMBL4515095 0.71 GRM5 (0.58) GRM5
SCHEMBL990230 0.70 GRM5 (0.74) GRM5
SCHEMBL23231138 0.65 HPGD (0.63) GABRA5HPGD
SCHEMBL12844641 0.64 GABRA5 (0.48) GABRA5GRM5HPGDALDH1A1HSD17B10
SCHEMBL12776443 0.64 HPGD (0.49) GABRA5GRM5HPGDMEN1KMT2A
SCHEMBL990140 0.63 GRM5 (0.80) GRM5
SCHEMBL94847 0.62 HPGD (0.56) GRM5HPGDPKMALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090005363-A1 Organic Compounds NOVARTIS AG (CH) 2009-01-01 US claimed

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-20090005363-A1 Organic Compounds NNT, NAPRT, CHRNA5 GABRA5 190/4885ABL1 2094/4885BCR 4777/4885

“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.