SCHEMBL4640460

SCHEMBL4640460

CN(C)CCCCNCCCCNCCCCN

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.78
CYP2C9 P11712 2/20 0.62
CYP2C19 P33261 2/20 0.62
CA12 O43570 3/20 0.59
CA2 P00918 3/20 0.59
CA4 P22748 3/20 0.59
CA6 P23280 3/20 0.59
CA5A P35218 3/20 0.59
CA7 P43166 3/20 0.59
CA9 Q16790 3/20 0.59
CA14 Q9ULX7 3/20 0.59
CA5B Q9Y2D0 3/20 0.59
ALOX15 P16050 3/20 0.59
TSHR P16473 3/20 0.59
F13A1 P00488 2/20 0.59
CYP1A2 P05177 2/20 0.59
THPO P40225 2/20 0.59
CA3 P07451 2/20 0.59
CA1 P00915 1/20 0.59
PKM P14618 1/20 0.59

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
SCHEMBL324163 1.00 TDP1 (0.78) TDP1CYP2C9CYP2C19CA12CA2
SCHEMBL322712 0.98 TDP1 (0.75) TDP1CYP2C9CYP2C19CA12CA2
SCHEMBL322565 0.98 TDP1 (0.75) TDP1CYP2C9CYP2C19CA12CA2
SCHEMBL7511401 0.95 TDP1 (0.86) TDP1CYP2C9CYP2C19CA12CA2
SCHEMBL7511391 0.95 TDP1 (0.86) TDP1CYP2C9CYP2C19CA12CA2
Hydrochloric Acid SCHEMBL7512946 0.93 TDP1 (0.83) TDP1CYP2C9CYP2C19CA12CA2
SCHEMBL11312897 0.93 TDP1 (0.83) TDP1CYP2C9CYP2C19CA12CA2
SCHEMBL6884423 0.93 TDP1 (0.83) TDP1CYP2C9CYP2C19CA12CA2
SCHEMBL11319774 0.93 TDP1 (0.83) TDP1CYP2C9CYP2C19CA12CA2
SCHEMBL6033697 0.93 TDP1 (0.83) TDP1CYP2C9CYP2C19CA12CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1419136-B1 POLYAMINES AND POLYMERS MADE THEREWITH INVISTA TECH SARL (CH) 2008-08-06 EP claimed
EP-1419196-B1 ACID DYEABLE POLYMER COMPOSITIONS INVISTA TECH SARL (US) 2007-11-14 EP claimed
EP-1419136-A2 POLYAMINES AND POLYMERS MADE THEREWITH INVISTA Technologies S.à.r.l. (US) 2004-05-19 EP claimed
EP-1419196-A1 ACID DYEABLE POLYMER COMPOSITIONS INVISTA Technologies S.à.r.l. (US) 2004-05-19 EP claimed
US-6723799-B2 BLENDS OF POLYESTER WITH NYLON; FIBERS, FABRICS AND FILMS E I. DU PONT DE NEMOURS AND COMPANY 2004-04-20 US claimed
US-20030083441-A1 Acid dyeable polymer compositions INVISTA NORTH AMERICA S.A.R.L. 2003-05-01 US claimed
WO-2003018689-A1 ACID DYEABLE POLYMER COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-03-06 WO claimed
US-20030045674-A1 Polyamines and polymers made therewith INVISTA NORTH AMERICA S.A.R.L. 2003-03-06 US claimed
WO-2003018533-A2 POLYAMINES AND POLYMERS MADE THEREWITH E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-03-06 WO claimed
EP-1419136-B1 POLYAMINES AND POLYMERS MADE THEREWITH INVISTA TECH SARL (CH) 2008-08-06 EP disclosed
EP-1419196-B1 ACID DYEABLE POLYMER COMPOSITIONS INVISTA TECH SARL (US) 2007-11-14 EP disclosed
CN-1547602-A Acid-dyeable polymer compositions ��Ļ���Ű˾ 2004-11-17 CN disclosed
US-6812325-B2 POLYAMIDES BASED ON DIAMINES HAVING TERTIARY AMINES WITH ALIPHATIC OR AROMATIC SUBSTITUENTS AND A SEPARATION OF >4 CARBON ATOMS BETWEEN ANY TWO NITROGEN GROUPS; POLYESTER/NYLON ADDITIVE TO INCREASE DYEABILITY BY ACID/BASIC DYES INVISTA NORTH AMERICA S.AR.L. 2004-11-02 US disclosed
EP-1419196-A1 ACID DYEABLE POLYMER COMPOSITIONS INVISTA Technologies S.à.r.l. (US) 2004-05-19 EP disclosed
US-6713653-B2 USEFUL FOR IMPROVING ACID-DYEABILITY OF POLYMER COMPOSITIONS, FIBERS, FABRICS, FILMS AND OTHER ARTICLES E. I. DU PONT DE NEMOURS AND COMPANY 2004-03-30 US disclosed
US-20030208031-A1 Polyamines and polymers made therewith E.I. DU PONT DE NEMOURS AND COMPANY 2003-11-06 US disclosed
US-20030083441-A1 Acid dyeable polymer compositions INVISTA NORTH AMERICA S.A.R.L. 2003-05-01 US disclosed
WO-2003018689-A1 ACID DYEABLE POLYMER COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-03-06 WO disclosed
US-20030045674-A1 Polyamines and polymers made therewith INVISTA NORTH AMERICA S.A.R.L. 2003-03-06 US disclosed
WO-2003018533-A2 POLYAMINES AND POLYMERS MADE THEREWITH E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-03-06 WO 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-20030045674-A1 Polyamines and polymers made therewith PNISR, SRM, SMS TDP1 1856/4885CYP2C9 3561/4885CYP2C19 3784/4885

“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.