SCHEMBL16017704

SCHEMBL16017704

CCCCN(N)CCOC

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
CTH P32929 1/20 0.32
PIK3CD O00329 1/20 0.32
CRHR1 P34998 1/20 0.31
CYP3A4 P08684 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP8 P22894 1/20 0.30

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
SCHEMBL16017718 0.85
SCHEMBL733846 0.84 PIK3CD (0.40) CTHPIK3CD
SCHEMBL1799094 0.82 TSHR (0.40)
SCHEMBL1072254 0.82 TSHR (0.40)
Bromide SCHEMBL11380568 0.79 DNM1 (0.41)
SCHEMBL20221379 0.77
SCHEMBL23477342 0.76 DNM1 (0.48)
SCHEMBL16333587 0.76 DNM1 (0.48)
SCHEMBL10436392 0.76
SCHEMBL12484771 0.76 HTR1B (0.44) CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9505737-B2 Treprostinil derivative compounds and methods of using same Corsair Pharma, Inc. (US) 2016-11-29 US disclosed
US-9371264-B2 Treprostinil derivative compounds and methods of using same Corsair Pharma, Inc. (US) 2016-06-21 US disclosed
US-20150166503-A1 TREPROSTINIL DERIVATIVE COMPOUNDS AND METHODS OF USING SAME Corsair Pharma, Inc. 2015-06-18 US disclosed
US-20140256730-A1 TREPROSTINIL DERIVATIVE COMPOUNDS AND METHODS OF USING SAME Corsair Pharma, Inc. (US) 2014-09-11 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-20150166503-A1 TREPROSTINIL DERIVATIVE COMPOUNDS AND METHODS OF USING SAME PTGIS, PTGIR, PTGER3 ADRB2 207/4885ADRB1 510/4885ADRB3 142/4885
US-20140256730-A1 TREPROSTINIL DERIVATIVE COMPOUNDS AND METHODS OF USING SAME PTGIS, PTGIR, PTGER3 ADRB2 207/4885ADRB1 510/4885ADRB3 142/4885

“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.