SCHEMBL5378592

SCHEMBL5378592

Oc1c(SCl)cccc1SCl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 3/20 0.38
HSD17B10 Q99714 2/20 0.38
CA1 P00915 2/20 0.38
HPGD P15428 2/20 0.38
ADAMTS4 O75173 1/20 0.38
EGFR P00533 1/20 0.38
FYN P06241 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
ALOX15 P16050 1/20 0.38
MMP8 P22894 1/20 0.38
CA6 P23280 1/20 0.38
CDK2 P24941 1/20 0.38
MMP12 P39900 1/20 0.38
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ADAMTS5 Q9UNA0 1/20 0.38
GABRA1 P14867 3/20 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
SCHEMBL7905207 0.78 HNF4A (0.48) ALDH1A1HSD17B10HPGD
SCHEMBL7187789 0.74
SCHEMBL8020131 0.74 ALOX15 (0.38) CA2ALDH1A1LMNAHSD17B10CA1
SCHEMBL1970573 0.74 APOBEC3G (0.38) LMNAHSD17B10HPGDAPOBEC3GTSHR
SCHEMBL5378587 0.73
SCHEMBL28338819 0.72 ALDH1A1 (0.36) CA2ALDH1A1LMNAHSD17B10CA1
Hydrogen Sulfide SCHEMBL10815992 0.72 ALDH1A1 (0.45) CA2ALDH1A1LMNAHSD17B10CA1
SCHEMBL199801 0.71 GABRA1 (0.42) CA2ALDH1A1LMNAHSD17B10CA1
SCHEMBL9633956 0.69 APOBEC3G (0.67) LMNAHPGDAPOBEC3GTSHRSLC6A2
SCHEMBL711355 0.68 CYP2C9 (0.56) HPGDMMP2MMP9MMP12TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104817801-B Inorganic-organic Hybrid Material and the optical material and inorganic-organic composite composition for having used the Inorganic-organic Hybrid Material 日本化成株式会社 2017-07-18 CN disclosed
CN-104208848-B golf ball 邓禄普体育用品株式会社 2017-04-12 CN disclosed
US-7279484-B2 Suppress tumor necrosis factor; Crohn's disease; imflammatory bowel disorders; sepsis; autoimmune disease AJINOMOTO CO., INC. (JP) 2007-10-09 US disclosed
US-20050250796-A1 Suppress tumor necrosis factor; Crohn's disease; imflammatory bowel disorders; sepsis; autoimmune disease AJINOMOTO CO., INC. (JP) 2005-11-10 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-20050250796-A1 Suppress tumor necrosis factor; Crohn's disease; imflammatory bowel disorders; sepsis; autoimmune disease TNF, NOD2, LITAF CA2 3056/4885ALDH1A1 3789/4885LMNA 1848/4885

“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.