SCHEMBL349109

SCHEMBL349109

O=[C]CCCc1c[nH]c2ccccc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.58
CYP3A4 P08684 3/20 0.57
HTR2A P28223 3/20 0.57
HTR2C P28335 2/20 0.57
CYP1A2 P05177 2/20 0.57
CYP2D6 P10635 2/20 0.57
MPO P05164 1/20 0.57
CYP2A6 P11509 1/20 0.57
NFKB1 P19838 1/20 0.57
HTR1D P28221 1/20 0.57
HTR1B P28222 1/20 0.57
HTR7 P34969 1/20 0.57
CTSK P43235 1/20 0.57
HTR6 P50406 1/20 0.57
CYP2A13 Q16696 1/20 0.57
TAAR1 Q96RJ0 1/20 0.57
HTR1A P08908 3/20 0.56
PMP22 Q01453 1/20 0.56
MAPT P10636 2/20 0.55
TDP1 Q9NUW8 2/20 0.55

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
SCHEMBL348936 0.90 HTR2A (0.61) SLC6A4CYP3A4HTR2AHTR2CCYP1A2
SCHEMBL7005718 0.84 HTR2A (0.71) SLC6A4CYP3A4HTR2AHTR2CCYP1A2
SCHEMBL7004146 0.84 HTR2A (0.71) SLC6A4CYP3A4HTR2AHTR2CCYP1A2
SCHEMBL347688 0.82 MEN1 (0.62) SLC6A4CYP3A4HTR2AHTR2CCYP1A2
SCHEMBL7001306 0.82 HTR2A (0.69) SLC6A4CYP3A4HTR2AHTR2CCYP1A2
SCHEMBL7004071 0.82 HTR2A (0.69) SLC6A4CYP3A4HTR2AHTR2CCYP1A2
SCHEMBL7889427 0.82 HTR2A (0.69) SLC6A4CYP3A4HTR2AHTR2CCYP1A2
SCHEMBL318663 0.81 SLC6A4 (0.63) SLC6A4CYP3A4HTR2AHTR2CCYP1A2
SCHEMBL4985934 0.80 HTR2A (0.77) SLC6A4CYP3A4HTR2AHTR2CCYP1A2
SCHEMBL10577333 0.79 SLC6A4 (0.61) SLC6A4CYP3A4HTR2AHTR2CCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10787484-B2 Compositions and methods for treating cardiovascular disease GENENTECH, INC. (US) 2020-09-29 US claimed
US-20190177366-A1 COMPOSITIONS AND METHODS FOR TREATING CARDIOVASCULAR DISEASE GENENTECH, INC. (US) 2019-06-13 US claimed
EP-0480918-A1 REDUCED SIZE LHRH ANALOGS ABBOTT LABORATORIES (US) 1992-04-22 EP claimed
EP-0480918-A4 REDUCED SIZE LHRH ANALOGS. ABBOTT LAB (US) 1991-06-04 EP claimed
EP-0417454-A2 Reduced size LHRH analogs ABBOTT LABORATORIES (US) 1991-03-20 EP claimed
WO-1989007451-A1 REDUCED SIZE LHRH ANALOGS ABBOTT LABORATORIES (US) 1989-08-24 WO claimed
EP-0328089-A2 Reduced size LHRH analogs ABBOTT LABORATORIES (US) 1989-08-16 EP claimed
US-11034725-B2 Compositions and methods for treating cardiovascular disease GENENTECH, INC. (US) 2021-06-15 US disclosed
US-10787484-B2 Compositions and methods for treating cardiovascular disease GENENTECH, INC. (US) 2020-09-29 US disclosed
US-20200283478-A1 COMPOSITIONS AND METHODS FOR TREATING CARDIOVASCULAR DISEASE GENENTECH, INC. (US) 2020-09-10 US disclosed
US-20190177366-A1 COMPOSITIONS AND METHODS FOR TREATING CARDIOVASCULAR DISEASE GENENTECH, INC. (US) 2019-06-13 US disclosed
US-8778871-B2 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-07-15 US disclosed
US-8765909-B2 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-07-01 US disclosed
EP-1556349-A1 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS 11-BETAHSD1 INHIBITORS Astrazeneca AB (SE) 2005-07-27 EP disclosed
US-20050124550-A1 Compounds that modulate the glucagon response and uses thereof THERATECHNOLOGIES INC. (CA) 2005-06-09 US disclosed
WO-2004111078-A2 COMPOUNDS THAT MODULATE THE GLUCAGON RESPONSE AND USES THEREOF THERATECHNOLOGIES INC. (CA) 2004-12-23 WO disclosed
WO-2004033427-A1 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS 11-BETAHSD1 INHIBITORS ASTRAZENECA AB (SE) 2004-04-22 WO disclosed
EP-0846127-A1 ACYLATED OLIGOPEPTIDE DERIVATIVES HAVING CELL SIGNAL INHIBITING ACTIVITY Novartis AG (CH) 1998-06-10 EP disclosed
WO-1997008193-A1 ACYLATED OLIGOPEPTIDE DERIVATIVES HAVING CELL SIGNAL INHIBITING ACTIVITY NOVARTIS AG (CH) 1997-03-06 WO disclosed
EP-0288965-A2 Peptides with a phospholipase A2 inhibiting activity HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-02 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 (5 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-20200283478-A1 COMPOSITIONS AND METHODS FOR TREATING CARDIOVASCULAR DISEASE PCSK9, PCSK7, PCSK6 SLC6A4 4813/4885CYP3A4 3635/4885HTR2A 3852/4885
US-11034725-B2 Compositions and methods for treating cardiovascular disease PCSK9, PCSK7, PCSK6 SLC6A4 4813/4885CYP3A4 3635/4885HTR2A 3852/4885
US-10787484-B2 Compositions and methods for treating cardiovascular disease PCSK9, PCSK7, PCSK6 SLC6A4 4813/4885CYP3A4 3635/4885HTR2A 3852/4885
US-20050124550-A1 Compounds that modulate the glucagon response and uses thereof GLP1R, GIPR, GPR119 SLC6A4 2581/4885CYP3A4 3636/4885HTR2A 2362/4885
US-20190177366-A1 COMPOSITIONS AND METHODS FOR TREATING CARDIOVASCULAR DISEASE PCSK9, PCSK7, PCSK6 SLC6A4 4813/4885CYP3A4 3635/4885HTR2A 3852/4885

“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.