SCHEMBL6930133

SCHEMBL6930133

C=CCOC(=O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
MAPK1 P28482 2/20 0.37
POLB P06746 1/20 0.37
CYP3A4 P08684 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 2/20 0.36
ATM Q13315 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
FAAH O00519 3/20 0.35
MGLL Q99685 1/20 0.35
LMNA P02545 1/20 0.34
RAB9A P51151 1/20 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
SCHEMBL18485435 1.00 TSHR (0.37) TSHRMAPK1POLBCYP3A4NPSR1
SCHEMBL18485441 0.83 HTT (0.40) TSHRPOLBCYP3A4NPSR1ALDH1A1
SCHEMBL5569659 0.80 KMT2A (0.44) TSHRPOLBNPSR1ALDH1A1ATM
SCHEMBL18485469 0.76 LMNA (0.40) TSHRNPSR1ALDH1A1ATMCA12
SCHEMBL8521913 0.73 CYP3A4 (0.43) TSHRMAPK1CYP3A4NPSR1ALDH1A1
SCHEMBL18485419 0.73 CYP3A4 (0.39) TSHRMAPK1CYP3A4NPSR1ALDH1A1
SCHEMBL28108459 0.72 FAAH (0.33) MAPK1CYP3A4NPSR1FAAHMGLL
SCHEMBL23812541 0.70 NPSR1 (0.40) TSHRMAPK1CYP3A4NPSR1ALDH1A1
SCHEMBL6831925 0.69 BCHE (0.41) TSHRMAPK1CYP3A4NPSR1ALDH1A1
SCHEMBL10768629 0.68 NPSR1 (0.63) TSHRMAPK1POLBCYP3A4NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6749990-B2 UNSATURATED HALOGENATED HYDROCARBON AS PHOTORESIST MONOMER, FOR EXAMPLE 3,3,4,4,5,5,6,6,6-NONAFLUORO-1-HEXENE; ETCHING RESISTANCE, HEAT RESISTANCE AND ADHESIVENESS, AND IS DEVELOPABLE IN AQUEOUS TETRAMETHYLAMMONIUM HYDROXIDE HYNIX SEMICONDUCTOR INC. (KR) 2004-06-15 US disclosed
US-20030017404-A1 Chemical amplification photoresist monomers, polymers therefrom and photoresist compositions containing the same HYNIX SEMICONDUCTOR INC. (KR) 2003-01-23 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-20030017404-A1 Chemical amplification photoresist monomers, polymers therefrom and photoresist compositions containing the same ETV6, UFM1, UTS2R TSHR 1899/4885MAPK1 1318/4885POLB 369/4885

“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.