SCHEMBL11273637

SCHEMBL11273637

COC(=O)C1=CC(C)(C)CC=C1

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA12 O43570 3/20 0.31
CA1 P00915 3/20 0.31
CA2 P00918 3/20 0.31
CA7 P43166 3/20 0.31
CA9 Q16790 3/20 0.31
CA14 Q9ULX7 3/20 0.31
TDP1 Q9NUW8 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL18483025 0.80 SLC6A2 (0.33)
SCHEMBL10563497 0.71 KDM4E (0.34) SMN1; SMN2
SCHEMBL18526279 0.69 TSHR (0.33) TSHRCA12CA1CA2CA7
SCHEMBL16810704 0.68
SCHEMBL896075 0.67 CHRM3 (0.39) TSHRSMN1; SMN2CA12CA1CA2
SCHEMBL11903300 0.67 GLA (0.31)
SCHEMBL17590183 0.66
SCHEMBL31097019 0.66 CHRM3 (0.35) TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL11179673 0.66 MAOA (0.37) TSHRSMN1; SMN2TDP1
SCHEMBL16599541 0.65 CA1 (0.36) TSHRCA12CA1CA2CA7

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
EP-0046377-A1 Cycloalkenylcarboxamido derivatives of tetramisole, their preparation and use in medicine BEECHAM GROUP PLC (GB) 1982-02-24 EP disclosed