SCHEMBL9129409

SCHEMBL9129409

CC=CCN1CCCCCC1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
PIK3CD O00329 1/20 0.43
HRH3 Q9Y5N1 1/20 0.41
KMT2A Q03164 2/20 0.41
CHRM2 P08172 3/20 0.40
CHRM5 P08912 3/20 0.40
CHRM1 P11229 3/20 0.40
CHRM3 P20309 3/20 0.40
CYP2D6 P10635 2/20 0.40
CYP1A2 P05177 1/20 0.40
CHRM4 P08173 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TSHR P16473 2/20 0.38
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
APEX1 P27695 2/20 0.37
PMP22 Q01453 2/20 0.37
MAPK1 P28482 2/20 0.37
ALOX12 P18054 1/20 0.37

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
SCHEMBL6543606 0.92 PIK3CD (0.50) PIK3CDKMT2ACHRM2CHRM5CHRM1
SCHEMBL9312216 0.79 TSHR (0.43) L3MBTL1PIK3CDHRH3KMT2ACHRM2
SCHEMBL4874408 0.79 L3MBTL1 (0.49) L3MBTL1PIK3CDHRH3KMT2ACHRM2
SCHEMBL15332861 0.79 L3MBTL1 (0.49) L3MBTL1PIK3CDHRH3KMT2ACHRM2
SCHEMBL7810580 0.78 L3MBTL1 (0.52) L3MBTL1PIK3CDHRH3KMT2ACHRM2
SCHEMBL22601369 0.78 L3MBTL1 (0.52) L3MBTL1PIK3CDHRH3KMT2ACHRM2
SCHEMBL459831 0.78 L3MBTL1 (0.52) L3MBTL1PIK3CDHRH3KMT2ACHRM2
SCHEMBL19456803 0.78 L3MBTL1 (0.52) L3MBTL1PIK3CDHRH3KMT2ACHRM2
SCHEMBL10426954 0.78 L3MBTL1 (0.52) L3MBTL1PIK3CDHRH3KMT2ACHRM2
SCHEMBL9391876 0.78 L3MBTL1 (0.52) L3MBTL1PIK3CDHRH3KMT2ACHRM2

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-5393592-A A coextruded multilayer thermoplastic styrene resins, free of protective coatings; impact strength, high melting; seals BASF AKTIENGESELLSCHAFT (DE) 1995-02-28 US disclosed