SCHEMBL7570331

SCHEMBL7570331

COc1ccccc1-c1cc(CO)ccc1C#N

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 10/20 0.51
AR P10275 5/20 0.48
PGR P06401 2/20 0.48
HTR1A P08908 7/20 0.47
HTR2B P41595 7/20 0.47
HTR5A P47898 6/20 0.47
HTR2C P28335 5/20 0.47
HTR1D P28221 5/20 0.47
HTR1B P28222 5/20 0.47
HTR2A P28223 5/20 0.47
HTR6 P50406 5/20 0.47
HTR1E P28566 3/20 0.47
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
HTR3A P46098 1/20 0.44
KCNN4 O15554 1/20 0.43
IMPDH2 P12268 1/20 0.43
IMPDH1 P20839 1/20 0.43

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
SCHEMBL7576242 0.81 AR (0.44) AR
SCHEMBL29805087 0.80 AR (0.58) ARPGRMAOAMAOBIMPDH2
SCHEMBL2786569 0.80 AR (0.58) ARPGRIMPDH2IMPDH1
SCHEMBL4504936 0.80 AR (0.58) ARPGRMAOAMAOBIMPDH2
SCHEMBL7570638 0.79 CYP19A1 (0.49) ARMAOAMAOB
SCHEMBL7569269 0.78 CSNK2A2 (0.41) AR
SCHEMBL1133173 0.78 KCNN4 (0.54) HTR7ARPGRMAOAMAOB
SCHEMBL7569928 0.77 GABRA1 (0.38) AR
SCHEMBL7572092 0.77 CYP19A1 (0.56) MAOAMAOB
SCHEMBL7569476 0.75 MCL1 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020019527-A1 Substituted phenyl farnesyltransferase inhibitors ABBOTT LABORATORIES 2002-02-14 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 (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-20020019527-A1 Substituted phenyl farnesyltransferase inhibitors FNTA, FNTB, SLC10A1 HTR7 4578/4885AR 4525/4885PGR 3080/4885

“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.