SCHEMBL12424656

SCHEMBL12424656

CCCCn1ccnc1C(C)C

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.59
POLB P06746 1/20 0.59
KMT2A Q03164 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.57
TLR8 Q9NR97 2/20 0.51
KCNH2 Q12809 3/20 0.40
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL25067265 0.95 TLR8 (0.59) ALDH1A1POLBKMT2ASMN1; SMN2TLR8
SCHEMBL5824074 0.93 TLR8 (0.57) ALDH1A1POLBKMT2ASMN1; SMN2TLR8
SCHEMBL18250324 0.93 TLR8 (0.57) ALDH1A1POLBKMT2ASMN1; SMN2TLR8
SCHEMBL28078170 0.93 TLR8 (0.57) ALDH1A1POLBKMT2ASMN1; SMN2TLR8
SCHEMBL15014467 0.89 SMN1; SMN2 (0.60) ALDH1A1POLBKMT2ASMN1; SMN2TLR8
SCHEMBL27721562 0.86 KMT2A (0.56) ALDH1A1POLBKMT2ASMN1; SMN2TLR8
SCHEMBL4396001 0.84 SMN1; SMN2 (0.55) ALDH1A1POLBKMT2ASMN1; SMN2TLR8
SCHEMBL25857294 0.84 SMN1; SMN2 (0.55) ALDH1A1POLBKMT2ASMN1; SMN2TLR8
SCHEMBL25067256 0.84 SMN1; SMN2 (0.55) ALDH1A1POLBKMT2ASMN1; SMN2TLR8
SCHEMBL3307602 0.83 ALDH1A1 (0.53) ALDH1A1POLBKMT2ASMN1; SMN2TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024129982-A2 CIRCULAR RNA COMPOSITIONS AND METHODS ORNA THERAPEUTICS, INC. (US) 2024-06-20 WO disclosed
US-20230227466-A1 SUBSTITUTED THIENOPYRIMIDINES THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE SHY THERAPEUTICS, LLC 2023-07-20 US disclosed
US-20230212629-A1 COMPOSITIONS AND METHODS FOR PRODUCING CIRCULAR POLYRIBONUCLEOTIDES FLAGSHIP PIONEERING INNOVATIONS VI, LLC 2023-07-06 US disclosed
US-20230212629-A1 COMPOSITIONS AND METHODS FOR PRODUCING CIRCULAR POLYRIBONUCLEOTIDES FLAGSHIP PIONEERING INNOVATIONS VI, LLC 2023-07-06 US disclosed
WO-2023056033-A1 LIPID NANOPARTICLE COMPOSITIONS FOR DELIVERING CIRCULAR POLYNUCLEOTIDES ORNA THERAPEUTICS, INC. (US) 2023-04-06 WO disclosed
CN-102216298-B Imidazopyridines and imidazopyrimidines as HIV-1 reverse transcriptase inhibitors CSIR INC 2014-04-16 CN disclosed
CN-102216298-A Imidazopyridines and imidazopyrimidines as HIV-1 reverse transcriptase inhibitors CSIR 2011-10-12 CN disclosed
US-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2011-08-18 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 (2 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-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF CCNY, CCNA1, CCNA2 ALDH1A1 1168/4885POLB 660/4885KMT2A 1997/4885
US-20230227466-A1 SUBSTITUTED THIENOPYRIMIDINES THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE KRAS, G3BP1, NRAS ALDH1A1 2378/4885POLB 2305/4885KMT2A 3255/4885

“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.