SCHEMBL4758951

SCHEMBL4758951

NCCCCCCNc1ncnc(NCCCCCCN)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1B Q9Y463 2/20 0.40
▸ PIM1 P11309 2/20 0.40
▸ PIM2 Q9P1W9 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ HSP90AB1 P08238 1/20 0.40
▸ F13A1 P00488 1/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.40
▸ STK17A Q9UEE5 2/20 0.39
▸ STK17B O94768 1/20 0.39
▸ NPY1R P25929 1/20 0.39
▸ NPY5R Q15761 1/20 0.39
▸ PRKCQ Q04759 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ KCNH3 Q9ULD8 1/20 0.37
▸ FERMT2 Q96AC1 1/20 0.36
▸ TLR8 Q9NR97 1/20 0.36

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
SCHEMBL19985663 0.88 HRH3 (0.43) HSP90AA1HSP90AB1CA12CA1CA2
SCHEMBL1273822 0.85 CA12 (0.45) PIM1HSP90AA1HSP90AB1F13A1CA12
SCHEMBL1272863 0.85 CA12 (0.45) PIM1HSP90AA1HSP90AB1F13A1CA12
SCHEMBL5797296 0.84 ALDH1A1 (0.41) DYRK1BHSP90AA1HSP90AB1F13A1CA12
SCHEMBL11935618 0.84 ALDH1A1 (0.41) DYRK1BHSP90AA1HSP90AB1F13A1CA12
SCHEMBL17563730 0.83 CXCR4 (0.46) CA12CA9STK17AALDH1A1FERMT2
SCHEMBL1274316 0.83 CA12 (0.46) PIM1F13A1CA12CA1CA2
SCHEMBL21574301 0.78 HRH3 (0.41) PIM1PIM2CA12CA1CA2
SCHEMBL20538899 0.78 ALDH1A1 (0.67) DYRK1BPIM1PIM2HSP90AA1HSP90AB1
SCHEMBL9489416 0.78 ALDH1A1 (0.67) DYRK1BPIM1PIM2HSP90AA1HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1279686-B1 Polymers from triazine derivatives AMI AGROLINZ MELAMINE INT GMBH (AT) 2008-08-20 — — EP disclosed
US-6818726-B2 FOR INTERMEDIATES AND MOLDED MATERIALS WITH IMPROVED TOUGHNESS AND HIGH FLAME RESISTANCE AND STRENGTH AGROLINZ MELAMIN GMBH (AT) 2004-11-16 — — US disclosed
US-6818768-B2 20-70% BY WEIGHT TRIAZINE DERIVATIVES WITH HYDROXYALKYL AMINO GROUPS AND 30-80% OF TRIAZINE DERIVATIVES WITH BIS/HYDROXYLAKYL)IMINO GROUP AGROLINZ MELAMIN GMBH (AT) 2004-11-16 — — US disclosed
US-20030050474-A1 Mixtures of triazine derivatives free from polyalkylene oxide AGROLINZ MELAMIN GMBH (AT) 2003-03-13 — — US disclosed
US-20030045667-A1 Polymers made from triazine derivatives AGROLINZ MELAMIN GMBH (AT) 2003-03-06 — — US disclosed
EP-1279686-A2 Polymers from triazine derivatives Agrolinz Melamin GmbH (AT) 2003-01-29 — — EP disclosed
EP-1279669-A2 Polyalkylene oxide-free mixture of triazine derivatives Agrolinz Melamin GmbH (AT) 2003-01-29 — — EP disclosed
EP-0643085-B1 Water-insoluble resins of melamine and formaldehyde BASF AG (DE) 1998-04-29 — — EP disclosed
US-5624466-A DYEING FIBERS, KNITS, NONWOVENS WITH AZO, ANTHRAQUINONE, COUMARIN, METHINE, QUINOPHTHALONE OR NITRO DYES BASF AKTIENGESELLSCHAFT (DE) 1997-04-29 — — US disclosed
EP-0768423-A2 Process for dyeing, printing, coating condensations products of melamin-formaldehyde, with pigments BASF Aktiengesellschaft (DE) 1997-04-16 — — EP disclosed
EP-0702107-A2 Process for dyeing melamine-formaldehyde condensation products BASF Aktiengesellschaft (DE) 1996-03-20 — — EP disclosed
EP-0643085-A1 Water-insoluble resins of melamine and formaldehyde BASF Aktiengesellschaft (DE) 1995-03-15 — — EP disclosed
US-5322915-A Modified melamine-formaldehyde resins BASF AKTIENGESELLSCHAFT (DE) 1994-06-21 — — US disclosed
EP-0523485-A1 Modified melamine-formaldehyde resins BASF Aktiengesellschaft (DE) 1993-01-20 — — 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-20030050474-A1 Mixtures of triazine derivatives free from polyalkylene oxide TAAR5, TAAR1, ARNT DYRK1B 4194/4885PIM1 2029/4885PIM2 1832/4885

“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.

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