SCHEMBL6480935

SCHEMBL6480935

Cc1cccc(C)c1C(=O)n1c(C)cc2cc(NC(=O)C3CCCCC3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.50
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
ALDH1A1 P00352 2/20 0.48
LMNA P02545 1/20 0.46
HSD17B10 Q99714 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPC1 O15118 1/20 0.44
KCNK3 O14649 1/20 0.44
KCNK9 Q9NPC2 1/20 0.44
ELANE P08246 1/20 0.44

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
SCHEMBL6480181 0.99 NPSR1 (0.51) NPSR1MAOAMAOBALDH1A1LMNA
SCHEMBL6490780 0.97 NPSR1 (0.48) NPSR1MAOAMAOBALDH1A1LMNA
SCHEMBL6489189 0.95 HSD17B10 (0.46) NPSR1MAOAMAOBALDH1A1LMNA
SCHEMBL6481059 0.91 NPSR1 (0.49) NPSR1MAOAMAOBALDH1A1LMNA
SCHEMBL6480891 0.89 NPSR1 (0.50) NPSR1MAOAMAOBALDH1A1LMNA
SCHEMBL6480722 0.88 NPSR1 (0.49) NPSR1MAOAMAOBALDH1A1LMNA
SCHEMBL6481240 0.88 GRM4 (0.49) NPSR1MAOAMAOBALDH1A1LMNA
SCHEMBL6492262 0.87 NPSR1 (0.47) NPSR1MAOAMAOBALDH1A1HPGD
SCHEMBL6481448 0.87 GRM4 (0.48) NPSR1MAOAMAOBALDH1A1HSD17B10
SCHEMBL6480771 0.86 NPSR1 (0.46) NPSR1MAOAMAOBALDH1A1HSD17B10

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-20050215614-A1 Substituted indoles and their use as hcv inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2005-09-29 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-20050215614-A1 Substituted indoles and their use as hcv inhibitors IDO1, IDO2, HAVCR2 NPSR1 556/4885MAOA 28/4885MAOB 25/4885

“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.