SCHEMBL62798

SCHEMBL62798

NCCCN(CCCO)CCCO

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
ALDH1A1 P00352 1/20 0.39
LCK P06239 2/20 0.36
NFKB1 P19838 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
CHRM2 P08172 1/20 0.32
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA3 P07451 2/20 0.32
CA4 P22748 2/20 0.32
CA6 P23280 2/20 0.32
CA5A P35218 2/20 0.32
CA7 P43166 2/20 0.32
CA9 Q16790 2/20 0.32
CA14 Q9ULX7 2/20 0.32
CA5B Q9Y2D0 2/20 0.32
DNM1 Q05193 1/20 0.32
LMNA P02545 1/20 0.32
BLM P54132 1/20 0.32

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
SCHEMBL64887 1.00 TSHR (0.39) TSHRALDH1A1LCKNFKB1TDP1
SCHEMBL14174729 0.95 TSHR (0.35) TSHRALDH1A1LCKNFKB1TDP1
SCHEMBL11041212 0.92 CHRM2 (0.42) TSHRALDH1A1LCKNFKB1CHRM2
SCHEMBL11591877 0.88 TSHR (0.39) TSHRALDH1A1LCKNFKB1TDP1
SCHEMBL1674639 0.88 TSHR (0.39) TSHRALDH1A1LCKNFKB1TDP1
SCHEMBL352467 0.88 TSHR (0.39) TSHRALDH1A1LCKNFKB1TDP1
SCHEMBL7770049 0.88 LCK (0.46) TSHRALDH1A1LCK
SCHEMBL817850 0.88 LCK (0.46) TSHRALDH1A1LCK
SCHEMBL24227290 0.87 CHRM2 (0.33) TSHRALDH1A1LCKCHRM2
SCHEMBL8204150 0.86 LCK (0.44) TSHRALDH1A1LCK

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 81 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104395367-A Amine catalyst for curing polyisocyanate compound and polyisocyanate adhesive composition containing amine catalyst for curing polyisocyanate compound TOSOH CORP 2015-03-04 CN claimed
US-20120157232-A1 MODIFICATION OF ACIDIC POLYMERS USING AMINOALCOHOLS TAYLOR MADE GOLF COMPANY, INC. 2012-06-21 US claimed
US-7105628-B2 Compositions for golf equipment ACUSHNET COMPANY (US) 2006-09-12 US claimed
US-20040220378-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-04 US claimed
US-20170260115-A1 METHOD FOR PRODUCING CIS- AND TRANS-ENRICHED MDACH BASF SE (DE) 2017-09-14 US disclosed
US-9433827-B2 Golf equipment formed from castable formulation with unconventionally low hardness and increased shear resistance ACUSHNET COMPANY (US) 2016-09-06 US disclosed
CN-103505994-B Acid gas absorbent, sour gas minimizing technology and sour gas removal device TOSHIBA CORP (JP) 2015-12-09 CN disclosed
US-20150072807-A1 GOLF EQUIPMENT FORMED FROM CASTABLE FORMULATION WITH UNCONVENTIONALLY LOW HARDNESS AND INCREASED SHEAR RESISTANCE ACUSHNET COMPANY (US) 2015-03-12 US disclosed
CN-104395367-A Amine catalyst for curing polyisocyanate compound and polyisocyanate adhesive composition containing amine catalyst for curing polyisocyanate compound TOSOH CORP 2015-03-04 CN disclosed
US-8907040-B2 Golf equipment formed from castable formulation with unconventionally low hardness and increased shear resistance ACUSHNET COMPANY (US) 2014-12-09 US disclosed
CN-103505994-A Acid gas absorbent, acid gas removal method, and acid gas removal device TOSHIBA KK 2014-01-15 CN disclosed
US-20130137537-A1 GOLF EQUIPMENT FORMED FROM CASTABLE FORMULATION WITH UNCONVENTIONALLY LOW HARDNESS AND INCREASED SHEAR RESISTANCE ACUSHNET COMPANY (US) 2013-05-30 US disclosed
WO-2000043483-A1 WATER REPELLENT FINISHING AGENT FOR HARD SURFACES BASF AKTIENGESELLSCHAFT (DE) 2000-07-27 WO disclosed
EP-1009791-A1 LAUNDRY DETERGENT COMPOSITIONS WITH AMINO ACID BASED POLYMERS TO PROVIDE APPEARANCE AND INTEGRITY BENEFITS TO FABRICS LAUNDERED THEREWITH THE PROCTER & GAMBLE COMPANY (US) 2000-06-21 EP disclosed
US-6034204-A Condensation products of basic amino acids with copolymerizable compounds and a process for their production BASF AKTIENGESELLSCHAFT (DE) 2000-03-07 US disclosed
WO-1999007814-A1 LAUNDRY DETERGENT COMPOSITIONS WITH AMINO ACID BASED POLYMERS TO PROVIDE APPEARANCE AND INTEGRITY BENEFITS TO FABRICS LAUNDERED THEREWITH THE PROCTER & GAMBLE COMPANY (US) 1999-02-18 WO disclosed
EP-0055386-B1 HAIR-DYEING PREPARATIONS Henkel Kommanditgesellschaft auf Aktien (DE) 1984-09-26 EP disclosed
US-3996285-A 1-(N-dihydroxyalkyl) aminoalkylene-2-propenyl substituted hydrocarbons ETHYL CORPORATION 1976-12-07 US disclosed
US-3960865-A Mono or bis 3-(polypropyl or butyl-propenyl)-amino alkyl piperazines STANDARD OIL COMPANY (US) 1976-06-01 US disclosed
US-3950426-A 1-Amino-2-propenyl and 1-amino-2-methylpropenyl alkane hydrocarbon STANDARD OIL COMPANY (US) 1976-04-13 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-20170260115-A1 METHOD FOR PRODUCING CIS- AND TRANS-ENRICHED MDACH ADH1C, MDH1, DNMT1 TSHR 2122/4885ALDH1A1 104/4885LCK 3594/4885

“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.