SCHEMBL2902002

SCHEMBL2902002

O=c1[nH]cnc2[nH]nc(I)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 1/20 0.43
ADORA2A P29274 1/20 0.43
SLC6A4 P31645 1/20 0.43
ADRA1A P35348 1/20 0.43
XDH P47989 1/20 0.43
RAB9A P51151 1/20 0.43
BLM P54132 1/20 0.43
DYRK1A Q13627 1/20 0.42
ACHE P22303 1/20 0.40
GDA Q9Y2T3 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
ALDH1A1 P00352 1/20 0.38
PARP1 P09874 5/20 0.36
PDPK1 O15530 3/20 0.36
ABL1 P00519 1/20 0.33
RIN1 Q13671 1/20 0.33
HPGD P15428 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
SCHEMBL3421432 0.77 TDP1 (0.36) SMN1; SMN2LMNAXDHALDH1A1HPGD
SCHEMBL20213686 0.77 LMNA (0.43) TSHRSMN1; SMN2LMNAADORA2ASLC6A4
SCHEMBL12535705 0.77 PDPK1 (0.49) TSHRSMN1; SMN2LMNAADORA2ASLC6A4
SCHEMBL6907428 0.77 LMNA (0.43) TSHRSMN1; SMN2LMNAADORA2ASLC6A4
SCHEMBL22292592 0.74 LMNA (0.41) TSHRSMN1; SMN2LMNAADORA2ASLC6A4
SCHEMBL18555761 0.73 BCAT2 (0.42) TSHRSMN1; SMN2LMNAADORA2ASLC6A4
SCHEMBL22488626 0.73 CYP1A2 (0.43) TSHRSMN1; SMN2LMNAADORA2ASLC6A4
SCHEMBL28918223 0.70 DYRK1A (0.38) TSHRSMN1; SMN2LMNAADORA2ASLC6A4
SCHEMBL408976 0.70 DYRK1A (0.55) TSHRSMN1; SMN2LMNARAB9ADYRK1A
SCHEMBL20187560 0.69 PDPK1 (0.49) DYRK1AACHEGDAALDH1A1PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115768764-B Parallel ring compound with anti-tumor activity and application thereof 上海翊石医药科技有限公司 2025-02-07 CN disclosed
EP-1975256-B1 Modified oligonucleotides for mismatch discrimination EPOCH BIOSCIENCES INC (US) 2012-07-11 EP disclosed
EP-1261616-B1 MODIFIED OLIGONUCLEOTIDES FOR MISMATCH DISCRIMINATION EPOCH BIOSCIENCES INC (US) 2010-08-18 EP disclosed
EP-1261616-B1 MODIFIED OLIGONUCLEOTIDES FOR MISMATCH DISCRIMINATION EPOCH BIOSCIENCES INC (US) 2010-08-18 EP disclosed
US-7751982-B2 TM leveling methods ELITECH HOLDING B.V. (NL) 2010-07-06 US disclosed
US-7751982-B2 TM leveling methods ELITECH HOLDING B.V. (NL) 2010-07-06 US disclosed
US-7751982-B2 TM leveling methods ELITECH HOLDING B.V. (NL) 2010-07-06 US disclosed
US-7715989-B2 Systems and methods for predicting oligonucleotide melting temperature (TmS) ELITECH HOLDING B.V. (NL) 2010-05-11 US disclosed
US-7715989-B2 Systems and methods for predicting oligonucleotide melting temperature (TmS) ELITECH HOLDING B.V. (NL) 2010-05-11 US disclosed
US-7715989-B2 Systems and methods for predicting oligonucleotide melting temperature (TmS) ELITECH HOLDING B.V. (NL) 2010-05-11 US disclosed
EP-1944310-A2 Modified oligonucleotides for mismatch discrimination Epoch Biosciences, Inc. (US) 2008-07-16 EP disclosed
US-7368549-B2 Tm leveling compositions EPOCH BIOSCIENCES, INC. (US) 2008-05-06 US disclosed
US-7368549-B2 Tm leveling compositions EPOCH BIOSCIENCES, INC. (US) 2008-05-06 US disclosed
US-7368549-B2 Tm leveling compositions EPOCH BIOSCIENCES, INC. (US) 2008-05-06 US disclosed
US-7045610-B2 Modified oligonucleotides for mismatch discrimination EPOCH BIOSCIENCES, INC. (US) 2006-05-16 US disclosed
US-20060003349-A1 Tm leveling compositions EPOCH BIOSCIENCES, INC. (US) 2006-01-05 US disclosed
US-20050075491-A1 TM leveling methods EPOCH BIOSCIENCES, INC. (US) 2005-04-07 US disclosed
US-6683173-B2 CONJUGATING OLIGONUCLEOTIDE WITH 3-SUBSTITUTED PYRAZOLO(3,4-D)PYRIMIDINES AND/OR 5-SUBSTITUTED PYRIMIDINE MINOR GROOVE BINDER EPOCH BIOSCIENCES, INC. 2004-01-27 US disclosed
US-20030235822-A1 Systems and methods for predicting oligonucleotide melting temperature (TmS) EPOCH BIOSCIENCES, INC. 2003-12-25 US disclosed
US-20030224359-A1 TMLEVELING METHODS EPOCH BIOSCIENCES, INC. 2003-12-04 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 (3 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-20060003349-A1 Tm leveling compositions RNGTT, TYMS, NT5C3B TSHR 992/4885SMN1; SMN2 1408/4885LMNA 458/4885
US-20050075491-A1 TM leveling methods RNGTT, TYMS, NT5C3B TSHR 582/4885SMN1; SMN2 1653/4885LMNA 451/4885
US-20030224359-A1 TMLEVELING METHODS PTBP3, RNGTT, DTYMK TSHR 884/4885SMN1; SMN2 1537/4885LMNA 1053/4885

“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.