SCHEMBL7577326

SCHEMBL7577326

COc1ccccc1-c1cc(C=O)ccc1C#N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.48
PGR P06401 2/20 0.48
IMPDH2 P12268 1/20 0.46
IMPDH1 P20839 1/20 0.46
ALDH1A1 P00352 6/20 0.46
TSHR P16473 1/20 0.46
TTR P02766 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
HPGD P15428 2/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
AOX1 Q06278 1/20 0.43
TRIM24 O15164 1/20 0.43
ALDH5A1 P51649 1/20 0.43
ABAT P80404 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TRIM33 Q9UPN9 1/20 0.43
ERN1 O75460 1/20 0.42
FDPS P14324 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL7570617 0.81 AR (0.44) ARALDH1A1TSHRHPGDKDM4E
SCHEMBL29953528 0.80 ALDH1A1 (0.67) IMPDH2IMPDH1ALDH1A1TSHRTTR
SCHEMBL14834816 0.80 ALDH1A1 (0.61) ALDH1A1TSHRTTRRXFP1HPGD
SCHEMBL31261976 0.80 ALDH1A1 (0.61) ARPGRIMPDH2IMPDH1ALDH1A1
SCHEMBL481230 0.80 ALDH1A1 (0.67) IMPDH2IMPDH1ALDH1A1TSHRTTR
SCHEMBL286401 0.80 ALDH1A1 (0.61) ARPGRIMPDH2IMPDH1ALDH1A1
SCHEMBL7575302 0.78 AR (0.38) ARALDH1A1RXFP1HPGDMAOA
SCHEMBL1133173 0.78 KCNN4 (0.54) ARPGRIMPDH2IMPDH1ALDH1A1
SCHEMBL26126274 0.78 HTR1A (0.55) ALDH1A1TSHRTTRRXFP1HPGD
SCHEMBL7577589 0.78 KDM4E (0.43) ARALDH1A1HPGDMAOAMAOB

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 AR 4525/4885PGR 3080/4885IMPDH2 1585/4885

“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.