SCHEMBL6294199

SCHEMBL6294199

[CH]1CC1COCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
TAAR1 Q96RJ0 1/20 0.46
LMNA P02545 1/20 0.46
BCHE P06276 2/20 0.45
ACHE P22303 2/20 0.45
CTSL P07711 1/20 0.44
CTSB P07858 1/20 0.44
CTSK P43235 1/20 0.44
IDO1 P14902 1/20 0.41
NAAA Q02083 1/20 0.41
AGXT P21549 1/20 0.40
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL600300 0.88 TSHR (0.52) TSHRTAAR1LMNABCHEACHE
SCHEMBL12983014 0.84 TSHR (0.52) TSHRTAAR1LMNABCHEACHE
SCHEMBL11840000 0.82 TSHR (0.45) TSHRTAAR1LMNABCHEACHE
SCHEMBL29023326 0.78 TSHR (0.45) TSHRTAAR1LMNABCHEACHE
SCHEMBL880157 0.78 TSHR (0.54) TSHRTAAR1LMNABCHEACHE
SCHEMBL28983607 0.78 TSHR (0.54) TSHRTAAR1LMNABCHEACHE
SCHEMBL6583251 0.77 TSHR (0.44) TSHRTAAR1LMNABCHEACHE
SCHEMBL1928095 0.77 TSHR (0.58) TSHRTAAR1LMNABCHEACHE
SCHEMBL22110584 0.77 TSHR (0.58) TSHRTAAR1LMNABCHEACHE
SCHEMBL17019782 0.77 TSHR (0.58) TSHRTAAR1LMNABCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6943184-B2 1,1- and 1,2-disubstituted cyclopropane compounds LES LABORATORIES SERVIER (FR) 2005-09-13 US disclosed
US-20050032845-A1 1,1-and 1,2-disubstituted cyclopropane compounds GOLDSTEIN SOLO (FR) 2005-02-10 US disclosed
US-20020022643-A1 1,1- and 1,2-disubstituted cyclopropane compounds ADIR ET COMPAGNIE (FR) 2002-02-21 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-20050032845-A1 1,1-and 1,2-disubstituted cyclopropane compounds CHRNA1, CHRNA4, CHRNB1 TSHR 201/4885TAAR1 122/4885LMNA 3499/4885
US-20020022643-A1 1,1- and 1,2-disubstituted cyclopropane compounds HCAR1, CHRNA1, CNR1 TSHR 260/4885TAAR1 78/4885LMNA 3399/4885

“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.