SCHEMBL16697215

SCHEMBL16697215

NCCNC(CN)CCC(CN)NCCN

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.38
CA6 P23280 4/20 0.38
CA7 P43166 4/20 0.38
CA9 Q16790 4/20 0.38
CA14 Q9ULX7 4/20 0.38
CA5B Q9Y2D0 4/20 0.38
CA2 P00918 3/20 0.38
CA4 P22748 3/20 0.38
CA5A P35218 3/20 0.38
CA3 P07451 2/20 0.38
MEN1 O00255 2/20 0.35
RECQL P46063 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
ALOX15 P16050 2/20 0.33
CA1 P00915 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
GGT1 P19440 1/20 0.33

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
SCHEMBL29736046 0.92 CA12 (0.36) CA12CA6CA7CA9CA14
SCHEMBL15319486 0.88
SCHEMBL29060972 0.87 CA12 (0.39) CA12CA6CA7CA9CA14
SCHEMBL29109505 0.85 GGT1 (0.33) CA12CA6CA7CA9CA14
SCHEMBL28988287 0.85 SIGMAR1 (0.33) CA12CA6CA7CA9CA14
Bromide SCHEMBL8397267 0.83 CA12 (0.31) CA12CA6CA7CA9CA14
Alcohol SCHEMBL9008030 0.79 LMNA (0.37) LMNATDP1GGT1KDM4E
SCHEMBL13764626 0.78 CA12 (0.38) CA12CA6CA7CA9CA14
SCHEMBL19934807 0.78
SCHEMBL10974606 0.78 DNM1 (0.41) MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067858-A1 ALIPHATIC EPOXY RESIN CROSSLINKED POLYMERS FOR PRIMARY CEMENTING IN A BOREHOLE SAUDI ARABIAN OIL COMPANY (SA) 2024-02-29 US claimed
EP-4374157-A2 FRET-BASED ASSAYS The General Hospital Corporation (US) 2024-05-29 EP disclosed
US-20240067858-A1 ALIPHATIC EPOXY RESIN CROSSLINKED POLYMERS FOR PRIMARY CEMENTING IN A BOREHOLE SAUDI ARABIAN OIL COMPANY (SA) 2024-02-29 US disclosed
WO-2023004438-A2 FRET-BASED ASSAYS THE GENERAL HOSPITAL CORPORATION (US) 2023-01-26 WO disclosed
US-11217435-B2 Tuned synthetic dendrimer calibrants for mass spectrometry THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2022-01-04 US disclosed
US-20200090917-A1 TUNED SYNTHETIC DENDRIMER CALIBRANTS FOR MASS SPECTROMETRY THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND 2020-03-19 US disclosed
US-10347476-B2 Tuned synthetic dendrimer calibrants for mass spectrometry THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2019-07-09 US disclosed
US-9713623-B2 Triazine cationic polymers and methods of use thereof THE CHARLOTTE-MECKLENBURG HOSPITAL AUTHORITY (US) 2017-07-25 US disclosed
US-20150273073-A1 TRIAZINE CATIONIC POLYMERS AND METHODS OF USE THEREOF THE CHARLOTTE MECKLENBURG HOSPITAL AUTHORITY D/B/A/ CAROLINAS HEALTHCARE SYSTEM 2015-10-01 US disclosed
US-20150132854-A1 Tuned Synthetic Dendrimer Calibrants for Mass Spectrometry THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND 2015-05-14 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 (4 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-11217435-B2 Tuned synthetic dendrimer calibrants for mass spectrometry SRMS, SRM, DNMT1 CA12 703/4885CA6 2567/4885CA7 2502/4885
US-10347476-B2 Tuned synthetic dendrimer calibrants for mass spectrometry SRMS, SRM, DNMT1 CA12 912/4885CA6 2829/4885CA7 2591/4885
US-20150273073-A1 TRIAZINE CATIONIC POLYMERS AND METHODS OF USE THEREOF SMN1; SMN2, TNNT2, MTPN CA12 2516/4885CA6 3072/4885CA7 2492/4885
US-20200090917-A1 TUNED SYNTHETIC DENDRIMER CALIBRANTS FOR MASS SPECTROMETRY SRMS, SRM, DNMT1 CA12 703/4885CA6 2567/4885CA7 2502/4885

“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.