SCHEMBL7968099

SCHEMBL7968099

CCCC(CC)NCC[O]

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
CNR1 P21554 1/20 0.41
ADRA1A P35348 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ABCC3 O15438 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SIGMAR1 Q99720 1/20 0.33
TAS1R3 Q7RTX0 2/20 0.32
TAS1R1 Q7RTX1 2/20 0.32

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
SCHEMBL28572587 0.86 LMNA (0.38) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL7965411 0.85
SCHEMBL10648742 0.82 LMNA (0.46) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL7952388 0.80
SCHEMBL4747287 0.78 SIGMAR1 (0.44) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL841070 0.78 SIGMAR1 (0.44) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL11491450 0.78 LMNA (0.42) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL1619179 0.76 LMNA (0.52) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL21695559 0.76 LMNA (0.46) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL28576682 0.76 SIGMAR1 (0.40) LMNACNR1ADRA1ATDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6204222-B1 SUITABLE AS HERBICIDES AND FOR DESICCATION/DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 2001-03-20 US disclosed
EP-0637298-B1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AG (DE) 1999-03-31 EP disclosed
US-5817603-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-10-06 US disclosed
US-5602074-A HERBICIDES; PLANT DESICCATION, DEFOLIATION BASF AKTIENGESELLSCHAFT (DE) 1997-02-11 US disclosed
EP-0637298-A1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF Aktiengesellschaft (DE) 1995-02-08 EP disclosed
WO-1993022280-A1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AKTIENGESELLSCHAFT (DE) 1993-11-11 WO disclosed