SCHEMBL12585031

SCHEMBL12585031

Cc1cc(N)ccc1Sc1nc2cc(Cl)ccc2s1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.56
▸ PPARA Q07869 7/20 0.46
▸ LOXL2 Q9Y4K0 1/20 0.46
▸ HSP90AA1 P07900 1/20 0.43
▸ HSP90AB1 P08238 1/20 0.43
▸ KEAP1 Q14145 1/20 0.43
▸ IDO1 P14902 1/20 0.43
▸ CTSD P07339 1/20 0.42
▸ ALOX5 P09917 3/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HSD17B10 Q99714 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
SCHEMBL12584997 0.84 SMN1; SMN2 (0.58) SMN1; SMN2NPSR1PPARALOXL2HSP90AA1
SCHEMBL2032147 0.84 SMN1; SMN2 (0.52) SMN1; SMN2NPSR1PPARALOXL2HSP90AA1
SCHEMBL12585006 0.81 SMN1; SMN2 (0.55) SMN1; SMN2NPSR1PPARALOXL2HSP90AA1
SCHEMBL12585038 0.80 SMN1; SMN2 (0.50) SMN1; SMN2NPSR1PPARAALOX5MEN1
SCHEMBL8564013 0.80 SMN1; SMN2 (0.59) SMN1; SMN2NPSR1PPARALOXL2HSP90AA1
SCHEMBL11601529 0.76 SMN1; SMN2 (0.57) SMN1; SMN2NPSR1PPARALOXL2IDO1
SCHEMBL1748171 0.73 SMN1; SMN2 (1.00) SMN1; SMN2NPSR1PPARALOXL2KEAP1
SCHEMBL30602946 0.73 SMN1; SMN2 (1.00) SMN1; SMN2NPSR1PPARALOXL2KEAP1
SCHEMBL8523609 0.72 SMN1; SMN2 (0.74) SMN1; SMN2NPSR1PPARALOXL2IDO1
SCHEMBL19840432 0.72 CTSD (0.52) SMN1; SMN2KEAP1CTSDMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968567-B2 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2011-06-28 — — US disclosed
US-7968567-B2 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2011-06-28 — — US disclosed
US-20100113522-A1 COMPOUNDS FOR THE MODULATION OF PPARgamma ACTIVITY AMGEN INC. (US) 2010-05-06 — — US disclosed
US-20100113522-A1 COMPOUNDS FOR THE MODULATION OF PPARgamma ACTIVITY AMGEN INC. (US) 2010-05-06 — — US disclosed
US-7626033-B2 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2009-12-01 — — US disclosed
US-7626033-B2 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2009-12-01 — — 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-20100113522-A1 COMPOUNDS FOR THE MODULATION OF PPARgamma ACTIVITY PPARG, PPARA, PPARD SMN1; SMN2 4250/4885NPSR1 3153/4885PPARA 2/4885

“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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