SCHEMBL105108

SCHEMBL105108

CCN(CC(C)C)C(C)C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.31
MAPK1 P28482 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
FDPS P14324 1/20 0.31

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
Ammonia Solution, Strong SCHEMBL27332852 0.97
SCHEMBL2478796 0.83 CA12 (0.35) CYP1A2MAPK1CA12CA1CA2
SCHEMBL20811 0.79
SCHEMBL21026948 0.77
SCHEMBL21937581 0.77
SCHEMBL18502210 0.77
SCHEMBL15179240 0.77 ALDH1A1 (0.36)
SCHEMBL20663578 0.77
SCHEMBL7856150 0.77 FDPS (0.36) CA1FDPS
SCHEMBL20243279 0.77 TSHR (0.40) FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250163022-A1 PARP1 INHIBITORS SYNNOVATION THERAPEUTICS, INC. 2025-05-22 US disclosed
EP-4452963-A1 PARP1 INHIBITORS Synnovation Therapeutics, Inc. (US) 2024-10-30 EP disclosed
CN-118696036-A PARP1 inhibitors 突触活化疗法股份有限公司 2024-09-24 CN disclosed
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 US disclosed
WO-2023230649-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-12-07 WO disclosed
WO-2023122140-A1 PARP1 INHIBITORS SYNNOVATION THERAPEUTICS, INC. (US) 2023-06-29 WO disclosed
WO-2023115165-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-06-29 WO disclosed
WO-2023115167-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-06-29 WO disclosed
WO-2023115166-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-06-29 WO disclosed
US-20230159491-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 US disclosed
US-20120059162-A1 FUSED IMIDAZOLE DERIVATIVE HAVING TTK INHIBITORY ACTION ONCOTHERAPY SCIENCE, INC. (JP) 2012-03-08 US disclosed
US-20120059162-A1 FUSED IMIDAZOLE DERIVATIVE HAVING TTK INHIBITORY ACTION ONCOTHERAPY SCIENCE, INC. (JP) 2012-03-08 US disclosed
US-20110130538-A1 PHOTOLYTIC ACID-GENERATING POLYMERS AND MONOMERS FOR THEIR CONSTRUCTION THE RESEARCH FOUNDATION OF THE STATE UNIVERSITY OF NEW YORK (US) 2011-06-02 US disclosed
US-20090264405-A1 Cetp Inhibitors MERCK SHARP & DOHME LLC 2009-10-22 US disclosed
US-20090264405-A1 Cetp Inhibitors MERCK SHARP & DOHME LLC 2009-10-22 US disclosed
US-7169814-B2 Guanidinium transport reagents and conjugates THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2007-01-30 US disclosed
US-20030143607-A1 Nucleic acid probes having highly hydrophilic non-nucleosidic tags with multiple labels, and uses thereof YANG GUOHAN (US) 2003-07-31 US disclosed
US-6504019-B2 Used in place of conventionally labeled oligonucleotides for a variety of hybridization reactions BAYER CORPORATION 2003-01-07 US disclosed
US-20020015953-A1 Nucleic acid probes having highly hydrophilic non-nucleosidic tags with multiple labels, and uses thereof BAYER CORPORATION 2002-02-07 US disclosed
EP-1136569-A2 Nucleic acid probes having highly hydrophilic non-nucleosidic tags with multiple labels, and uses thereof Bayer Corporation (US) 2001-09-26 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 (8 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-20090264405-A1 Cetp Inhibitors CETP, APOB, PCSK9 CYP1A2 1678/4885MAPK1 3196/4885CA12 4755/4885
US-20120059162-A1 FUSED IMIDAZOLE DERIVATIVE HAVING TTK INHIBITORY ACTION NR0B1, GRK7, NR5A2 CYP1A2 1779/4885MAPK1 1559/4885CA12 4580/4885
US-20230159491-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 CYP1A2 3539/4885MAPK1 2873/4885CA12 3434/4885
US-20250163022-A1 PARP1 INHIBITORS PARP1, PARP11, PARP12 CYP1A2 4164/4885MAPK1 1787/4885CA12 4719/4885
US-20110130538-A1 PHOTOLYTIC ACID-GENERATING POLYMERS AND MONOMERS FOR THEIR CONSTRUCTION PPOX, ALAD, PGAM1 CYP1A2 1938/4885MAPK1 1926/4885CA12 2616/4885
US-20020015953-A1 Nucleic acid probes having highly hydrophilic non-nucleosidic tags with multiple labels, and uses thereof DNTT, NSUN3, NCL CYP1A2 4874/4885MAPK1 4303/4885CA12 2952/4885
US-20030143607-A1 Nucleic acid probes having highly hydrophilic non-nucleosidic tags with multiple labels, and uses thereof DNTT, NSUN3, NCL CYP1A2 4874/4885MAPK1 4303/4885CA12 2952/4885
US-20240228478-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 CYP1A2 50/4885MAPK1 4173/4885CA12 1198/4885

“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.