SCHEMBL181293

SCHEMBL181293

[CH2]CCCCCc1ncc[nH]1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.59
TERT O14746 1/20 0.50
ALOX15 P16050 1/20 0.41
TAAR1 Q96RJ0 9/20 0.40
FDPS P14324 1/20 0.36
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
CYP2D6 P10635 1/20 0.33
TSHR P16473 1/20 0.33
FPR2 P25090 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
SCHEMBL25318421 1.00 TBXAS1 (0.59) TBXAS1TERTALOX15TAAR1FDPS
SCHEMBL25320538 1.00 TBXAS1 (0.59) TBXAS1TERTALOX15TAAR1FDPS
SCHEMBL25315545 1.00 TBXAS1 (0.59) TBXAS1TERTALOX15TAAR1FDPS
SCHEMBL25316108 1.00 TBXAS1 (0.59) TBXAS1TERTALOX15TAAR1FDPS
SCHEMBL181392 0.98 TBXAS1 (0.56) TBXAS1TERTALOX15TAAR1FDPS
SCHEMBL181705 0.92
SCHEMBL28062565 0.89 TBXAS1 (0.69) TBXAS1TERTALOX15TAAR1FDPS
SCHEMBL503743 0.89 TBXAS1 (0.69) TBXAS1TERTALOX15TAAR1FDPS
SCHEMBL3431746 0.87 TBXAS1 (0.66) TBXAS1TERTALOX15TAAR1FDPS
SCHEMBL181657 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10421954-B2 Hybrid polymers, pharmaceutical compositions and methods of synthesizing the same NEW YORK UNIVERSITY (US) 2019-09-24 US claimed
US-9969773-B2 Polymers, pharmaceutical compositions and methods of synthesizing the same NEW YORK UNIVERSITY (US) 2018-05-15 US claimed
US-20170015991-A1 HYBRID POLYMERS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF SYNTHESIZING THE SAME NEW YORK UNIVERSITY 2017-01-19 US claimed
US-9458449-B2 Hybrid polymers, pharmaceutical compositions and methods of synthesizing the same NEW YORK UNIVERSITY (US) 2016-10-04 US claimed
US-20150044189-A1 HYBRID POLYMERS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF SYNTHESIZING THE SAME NEW YORK UNIVERSITY 2015-02-12 US claimed
US-20150011465-A1 PEPTOID OLIGOMERS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME NEW YORK UNIVERSITY 2015-01-08 US claimed
US-8828413-B2 Peptoid oligomers, pharmaceutical compositions and methods of using the same NEW YORK UNIVERSITY (US) 2014-09-09 US claimed
EP-2401264-A2 PEPTOID OLIGOMERS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME New York University (US) 2012-01-04 EP claimed
WO-2011156003-A2 PEPTOID AND SYNTHETIC OLIGOMERS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING SAME NEW YORK UNIVERSITY (US) 2011-12-15 WO claimed
WO-2010098843-A2 PEPTOID OLIGOMERS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME NEW YORK UNIVERSITY (US) 2010-09-02 WO claimed
US-20240165245-A1 MULTIVALENT PEPTOID OLIGOMERS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING SAME NEW YORK UNIVERSITY (US) 2024-05-23 US disclosed
US-20230303404-A1 NANOPARTICLES, DISPERSION OF NANOPARTICLES, AND PRODUCTION METHOD OF NANOPARTICLES TOKYO OHKA KOGYO CO., LTD. (JP) 2023-09-28 US disclosed
US-11766480-B2 Multivalent peptoid oligomers, pharmaceutical compositions and methods of using same NEW YORK UNIVERSITY (US) 2023-09-26 US disclosed
US-20230242692-A1 COMPOSITION AND CURED PRODUCT TOKYO OHKA KOGYO CO., LTD. (JP) 2023-08-03 US disclosed
CN-116515023-A Composition and cured product 东京应化工业株式会社 2023-08-01 CN disclosed
WO-1995000468-A1 FLUORENONE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND CENTRAL OR PERIPHERAL NERVE DEGENERATION REPAIR AND PROTECTIVE AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-01-05 WO disclosed
EP-0620003-A1 VASOPRESSIN ANTAGONIST AND OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-19 EP disclosed
EP-0612319-A1 BENZOHETEROCYCLIC COMPOUNDS AS OXYTOCIN AND VASOPRESSIN ANTAGONISTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-08-31 EP disclosed
CN-1090576-A Benzoheterocyclic compounds OTSUKA PHARMA CO LTD (JP) 1994-08-10 CN disclosed
WO-1994004525-A1 BENZOHETEROCYCLIC COMPOUNDS AS OXYTOCIN AND VASOPRESSIN ANTAGONISTS OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1994-03-03 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 (6 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-20150011465-A1 PEPTOID OLIGOMERS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME NOD2, VIP, NOD1 TBXAS1 1582/4885TERT 2224/4885ALOX15 637/4885
US-10421954-B2 Hybrid polymers, pharmaceutical compositions and methods of synthesizing the same F12, RPS4Y1, NPY1R TBXAS1 635/4885TERT 1932/4885ALOX15 3574/4885
US-20240165245-A1 MULTIVALENT PEPTOID OLIGOMERS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING SAME AR, SHBG, KLK3 TBXAS1 1008/4885TERT 3296/4885ALOX15 1525/4885
US-20170015991-A1 HYBRID POLYMERS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF SYNTHESIZING THE SAME F12, RPS4Y1, NPY1R TBXAS1 635/4885TERT 1932/4885ALOX15 3574/4885
US-20230303404-A1 NANOPARTICLES, DISPERSION OF NANOPARTICLES, AND PRODUCTION METHOD OF NANOPARTICLES CD63, NIBAN2, ZRANB2 TBXAS1 1738/4885TERT 1995/4885ALOX15 2114/4885
US-11766480-B2 Multivalent peptoid oligomers, pharmaceutical compositions and methods of using same AR, SHBG, KLK3 TBXAS1 1008/4885TERT 3296/4885ALOX15 1525/4885

“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.