SCHEMBL7918753

SCHEMBL7918753

N#Cc1cc(F)cc(F)c1I

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 3/20 0.39
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
KHK P50053 1/20 0.33
DHODH Q02127 1/20 0.33
AR P10275 1/20 0.32
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL25910696 0.78 CYP11B1 (0.37) TRPV4CYP11B1CYP11B2KHKDHODH
SCHEMBL1996117 0.76 TRPV4 (0.41) TRPV4CYP11B1CYP11B2KHKDHODH
SCHEMBL2234841 0.74 TRPV4 (0.48) TRPV4CYP11B1CYP11B2KHKDHODH
SCHEMBL2929573 0.74 CES2 (0.36)
SCHEMBL2651893 0.73 TRPV4 (0.39) TRPV4CYP11B1CYP11B2KHKDHODH
SCHEMBL2652439 0.73 ADRB2 (0.44) TRPV4CYP11B1CYP11B2KHKDHODH
SCHEMBL29786557 0.73 ERN1 (0.42) TRPV4CYP11B1CYP11B2KHKDHODH
SCHEMBL20597951 0.73 KHK (0.41) TRPV4CYP11B1CYP11B2KHKDHODH
SCHEMBL4254090 0.73 ERN1 (0.42) TRPV4CYP11B1CYP11B2KHKDHODH
SCHEMBL13525263 0.73 DHODH (0.40) TRPV4CYP11B1CYP11B2KHKDHODH

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-20110306621-A1 ACYLGUANIDINE DERIVATIVES ASTELLAS PHARMA INC. (JP) 2011-12-15 US disclosed
US-20110306621-A1 ACYLGUANIDINE DERIVATIVES ASTELLAS PHARMA INC. (JP) 2011-12-15 US disclosed
EP-2394987-A1 ACYLGUANIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2011-12-14 EP disclosed
WO-2010090304-A1 ACYLGUANIDINE DERIVATIVE アステラス製薬株式会社 (JP) 2010-08-12 WO 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 (1 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-20110306621-A1 ACYLGUANIDINE DERIVATIVES HTR5A, HTR2A, HTR1A TRPV4 1593/4885CYP11B1 766/4885CYP11B2 748/4885

“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.