SCHEMBL9914232

SCHEMBL9914232

CSc1ccc(C)cc1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC7 Q8WUI4 1/20 0.45
PSMB5 P28074 1/20 0.43
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 4/20 0.42
MAPT P10636 3/20 0.42
HPGD P15428 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
NPC1 O15118 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.42
LMNA P02545 2/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
MAOB P27338 2/20 0.40
ELANE P08246 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL575883 0.86 HDAC7 (0.46) HDAC7PSMB5ALDH1A1KDM4EMAPT
SCHEMBL576376 0.86 HDAC7 (0.46) HDAC7PSMB5ALDH1A1KDM4EMAPT
SCHEMBL30849634 0.86 PSMB5 (0.44) HDAC7PSMB5ALDH1A1KDM4EMAPT
SCHEMBL1787742 0.82 HDAC7 (0.44) HDAC7PSMB5ALDH1A1KDM4EMAPT
SCHEMBL30849632 0.82 HPRT1 (0.44) HDAC7PSMB5ALDH1A1KDM4EMAPT
SCHEMBL18594367 0.82 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTHPGDRAB9A
SCHEMBL28223280 0.81 PTGDR2 (0.44) HDAC7PSMB5ALDH1A1KDM4EMAPT
SCHEMBL13750090 0.81 HTR1A (0.47) HDAC7PSMB5ALDH1A1KDM4EMAPT
SCHEMBL25811691 0.79 MAPT (0.43) HDAC7PSMB5ALDH1A1KDM4EMAPT
SCHEMBL2649579 0.78 MAOA (0.42) ALDH1A1KDM4EMAPTHPGDRAB9A

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-20220134323-A1 CATALYST FOR HYDROGENATION REACTION AND METHOD FOR PRODUCING SAME LG CHEM, LTD. (KR) 2022-05-05 US disclosed
EP-3903934-A1 CATALYST FOR HYDROGENATION REACTION AND METHOD FOR PRODUCING SAME LG Chem, Ltd. (KR) 2021-11-03 EP disclosed
US-8198205-B2 Aromatic block copolymer, decomposition method thereof and analysis method using the decomposition method SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-06-12 US disclosed
US-20110081597-A1 POLYMER ELECTROLYTE, CROSSLINKED POLYMER ELECTROLYTE, POLYMER ELECTROLYTE MEMBRANE AND USE OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-04-07 US disclosed
US-20100239947-A1 Condensed ring-containing polymer electrolyte and application thereof SUMITOMO CHEMICAL COMPANY, LIMITED 2010-09-23 US disclosed
US-20090197763-A1 Aromatic block copolymer, decomposition method thereof and analysis method using the decomposition method SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-08-06 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-20220134323-A1 CATALYST FOR HYDROGENATION REACTION AND METHOD FOR PRODUCING SAME GRHPR, HAO2, RAD51 HDAC7 1810/4885PSMB5 3221/4885ALDH1A1 1529/4885

“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.