SCHEMBL9925967

SCHEMBL9925967

NC1=CC(=O)CC(c2cccs2)C1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.67
GAA P10253 2/20 0.67
MAPT P10636 2/20 0.67
HCAR2 Q8TDS4 1/20 0.39
NOS3 P29474 2/20 0.37
NOS2 P35228 2/20 0.37
ALDH1A1 P00352 5/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
MAP1LC3B Q9GZQ8 2/20 0.36
TSHR P16473 2/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 3/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
LMNA P02545 1/20 0.36
AGTR1 P30556 1/20 0.36
HSD17B10 Q99714 2/20 0.36
GLA P06280 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL1520716 0.80 POLB (1.00) POLBGAAMAPTHCAR2ALDH1A1
SCHEMBL1781122 0.73 MAPT (0.57) POLBGAAMAPTHCAR2ALDH1A1
SCHEMBL7687698 0.72 ALDH1A1 (0.36) POLBGAAMAPTALDH1A1KMT2A
SCHEMBL4421957 0.72 SMN1; SMN2 (0.56) POLBGAAMAPTALDH1A1KMT2A
SCHEMBL657849 0.72 POLB (0.56) POLBGAAMAPTHCAR2ALDH1A1
SCHEMBL7685181 0.71 ALDH1A1 (0.36) POLBGAAMAPTALDH1A1KMT2A
SCHEMBL1781576 0.69 POLB (0.56) POLBGAAMAPTHCAR2ALDH1A1
SCHEMBL497608 0.69
SCHEMBL11471110 0.69 MAPT (0.51) POLBGAAMAPTHCAR2NOS3
SCHEMBL7686920 0.68 LDHA (0.44) POLBALDH1A1MAP1LC3BHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120214824-A1 PROTEOSTASIS REGULATORS PROTEOSTASIS THERAPEUTICS, INC. 2012-08-23 US disclosed
US-20120214824-A1 PROTEOSTASIS REGULATORS PROTEOSTASIS THERAPEUTICS, INC. 2012-08-23 US disclosed
WO-2012078902-A2 PROTEOSTASIS REGULATORS PROTEOSTASIS THERAPEUTICS, INC. (US) 2012-06-14 WO 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-20120214824-A1 PROTEOSTASIS REGULATORS PSMG3, HSPA5, HSP90B1 POLB 2511/4885GAA 650/4885MAPT 357/4885

“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.