SCHEMBL8643271

SCHEMBL8643271

CC(C)C1CN(c2ccccc2)CCO1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.47
▸ FFAR2 O15552 1/20 0.43
▸ BPTF Q12830 1/20 0.40
▸ NOTUM Q6P988 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.38
▸ MAP3K5 Q99683 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ GFER P55789 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ CHRNA7 P36544 2/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ CHRNB2 P17787 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ CHRNA3 P32297 1/20 0.37
▸ CHRNA4 P43681 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MEN1 O00255 1/20 0.36

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
SCHEMBL24681614 0.84 NOTUM (0.41) FFAR2NOTUMMEN1KMT2ASMN1; SMN2
SCHEMBL24681245 0.84 NOTUM (0.41) FFAR2NOTUMMEN1KMT2ASMN1; SMN2
SCHEMBL24681247 0.84 NOTUM (0.41) FFAR2NOTUMMEN1KMT2ASMN1; SMN2
SCHEMBL13113465 0.81 ALDH1A1 (0.38) LMNAFFAR2HRH3ALDH1A1KDM4E
SCHEMBL10309786 0.80 AGXT (0.40) FFAR2NOTUM
SCHEMBL24681252 0.77 LMNA (0.52) LMNAFFAR2BPTFNOTUMCHRNA7
SCHEMBL4855532 0.77 LMNA (0.52) LMNAFFAR2BPTFNOTUMCHRNA7
SCHEMBL24680783 0.77 LMNA (0.52) LMNAFFAR2BPTFNOTUMCHRNA7
SCHEMBL29157655 0.77 NOTUM (0.45) LMNANOTUMALDH1A1L3MBTL1MAPK1
SCHEMBL29157654 0.77 NOTUM (0.45) LMNANOTUMALDH1A1L3MBTL1MAPK1

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-5773437-A UROGENITAL DISORDERS SUCH AS DYSURIA NIPPON CHEMIPHAR CO., LTD. (JP) 1998-06-30 — — US disclosed
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