SCHEMBL9140201

SCHEMBL9140201

OCCc1ccccc1CBr

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.44
TSHR P16473 3/20 0.36
ALDH1A1 P00352 2/20 0.36
TRPA1 O75762 1/20 0.36
PTPN1 P18031 2/20 0.35
APOBEC3G Q9HC16 1/20 0.34
TAAR1 Q96RJ0 2/20 0.33
HSPA5 P11021 1/20 0.33
FFAR1 O14842 1/20 0.33
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
CA2 P00918 1/20 0.32
HTR1A P08908 1/20 0.31
HTR2A P28223 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL29534868 0.87 TDP1 (0.55) TDP1TSHRALDH1A1PTPN1APOBEC3G
SCHEMBL31203 0.87 TDP1 (0.55) TDP1TSHRALDH1A1PTPN1APOBEC3G
Bromide SCHEMBL8311140 0.84 POLB (0.37) TDP1TSHRALDH1A1TRPA1APOBEC3G
SCHEMBL15960323 0.84 TRPA1 (0.43) TDP1TSHRALDH1A1TRPA1TAAR1
SCHEMBL29382225 0.81 TSHR (0.50) TDP1TSHRALDH1A1TRPA1PTPN1
SCHEMBL28289 0.81 TSHR (0.50) TDP1TSHRALDH1A1TRPA1PTPN1
SCHEMBL5497045 0.80 TSHR (0.36) TDP1TSHRALDH1A1TRPA1APOBEC3G
SCHEMBL32679673 0.79 TDP1 (0.48) TDP1TSHRALDH1A1TRPA1PTPN1
SCHEMBL30563551 0.79 APOBEC3G (0.48) TDP1TSHRALDH1A1PTPN1APOBEC3G
SCHEMBL27891 0.79 APOBEC3G (0.48) TDP1TSHRALDH1A1PTPN1APOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170114341-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS BRADSHAW CURT W (US) 2017-04-27 US disclosed
US-20170114341-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS BRADSHAW CURT W (US) 2017-04-27 US disclosed
US-20160257961-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING DISULFIDE GROUPS BRADSHAW CURT W (US) 2016-09-08 US disclosed
US-20160257961-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING DISULFIDE GROUPS BRADSHAW CURT W (US) 2016-09-08 US disclosed
WO-2015188197-A2 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS SOLSTICE BIOLOGICS, LTD. (IE) 2015-12-10 WO disclosed
WO-2015069932-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING DISULFIDE GROUPS SOLSTICE BIOLOGICS, LTD. (IE) 2015-05-14 WO disclosed
CN-1914173-A Quinolines useful in treating cardiovascular disease WYETH CORP (US) 2007-02-14 CN disclosed
US-5476846-A Administering anti-thrombotic and anti-asthmatic agent LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1995-12-19 US disclosed
US-5387709-A Bronchodilator agents, anticoagulants, vasodilation LIPHA LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1995-02-07 US disclosed
EP-0472449-B1 Substituted sulfonamides, processes for their preparation and medicines containing them LIPHA (FR) 1994-09-14 EP disclosed
EP-0472449-A2 Substituted sulfonamides, processes for their preparation and medicines containing them LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1992-02-26 EP 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-20170114341-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS HNRNPC, RNASE1, NSUN3 TDP1 495/4885TSHR 3447/4885ALDH1A1 4316/4885

“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.