SCHEMBL1199290

SCHEMBL1199290

CC(C)=CCCC(C)CCOS(C)(=O)=O

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.60
ALDH1A1 P00352 3/20 0.52
NFE2L2 Q16236 1/20 0.44
USP2 O75604 2/20 0.40
TSHR P16473 2/20 0.40
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
MMP9 P14780 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
EPHX2 P34913 1/20 0.36
GGPS1 O95749 2/20 0.34
FDPS P14324 2/20 0.34

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
SCHEMBL1199287 1.00 ALOX15 (0.60) ALOX15ALDH1A1NFE2L2USP2TSHR
SCHEMBL7618433 0.81 USP2 (0.55) ALOX15ALDH1A1USP2TSHRKDM4E
SCHEMBL8059226 0.77 ALOX15 (0.67) ALOX15ALDH1A1NFE2L2USP2TSHR
SCHEMBL8397532 0.77 ALOX15 (0.67) ALOX15ALDH1A1NFE2L2USP2TSHR
SCHEMBL4861727 0.76 ALOX15 (0.49) ALOX15ALDH1A1NFE2L2USP2TSHR
SCHEMBL4448966 0.76 ALOX15 (0.65) ALOX15ALDH1A1NFE2L2USP2TSHR
SCHEMBL27200268 0.76 ALOX15 (0.65) ALOX15ALDH1A1NFE2L2USP2TSHR
SCHEMBL14581768 0.76 ALOX15 (0.65) ALOX15ALDH1A1NFE2L2USP2TSHR
SCHEMBL17955374 0.76 ALOX15 (0.65) ALOX15ALDH1A1NFE2L2USP2TSHR
SCHEMBL6191964 0.76 ALOX15 (0.56) ALOX15ALDH1A1USP2TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113880737-B Application of novel persulfate reagent in synthesis of asymmetric polysulfide 安徽农业大学 2023-09-15 CN disclosed
CN-113880737-A Application of novel persulfur reagent in synthesis of asymmetric persulfur 安徽农业大学 2022-01-04 CN disclosed
US-20110039899-A1 Gabapentin for the Treatment of Overactive Bladder, Stress Incontinence and BPH PFIZER INC 2011-02-17 US disclosed
US-5506345-A ANTIHYPOXIC AGENTS AMERSHAM INTERNATIONAL PLC (GB) 1996-04-09 US disclosed
US-5387692-A A bisamine oxime compound containing a 2-nitroimidazole group AMERSHAM INTERNATIONAL PLC (GB) 1995-02-07 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-20110039899-A1 Gabapentin for the Treatment of Overactive Bladder, Stress Incontinence and BPH GABRB2, GABRB3, GABRB1 ALOX15 2292/4885ALDH1A1 581/4885NFE2L2 866/4885

“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.