SCHEMBL7547962

SCHEMBL7547962

CCCC/C=C/C(C)C[O]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
CYP3A4 P08684 2/20 0.37
FAAH O00519 2/20 0.37
TRPV1 Q8NER1 2/20 0.37
ASAH2 Q9NR71 2/20 0.37
F7 P08709 1/20 0.36
F3 P13726 1/20 0.36
MAPT P10636 4/20 0.35
ALDH1A1 P00352 4/20 0.35
MAPK1 P28482 3/20 0.35
CYP2D6 P10635 3/20 0.35
CYP1A2 P05177 3/20 0.35
CYP2C9 P11712 3/20 0.35
CYP2C19 P33261 3/20 0.35
GMNN O75496 2/20 0.35
LMNA P02545 2/20 0.35
GLA P06280 2/20 0.35
POLB P06746 2/20 0.35

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
SCHEMBL7547964 1.00 TSHR (0.39) TSHRMEN1KMT2ACYP3A4FAAH
SCHEMBL7554556 0.86
SCHEMBL7554553 0.86
SCHEMBL7287328 0.84 LTB4R (0.48) MEN1KMT2ACYP3A4FAAHTRPV1
SCHEMBL7287321 0.84 LTB4R (0.48) MEN1KMT2ACYP3A4FAAHTRPV1
SCHEMBL2008706 0.81 MEN1 (0.39) TSHRMEN1KMT2ACYP3A4FAAH
SCHEMBL2008705 0.81 MEN1 (0.39) TSHRMEN1KMT2ACYP3A4FAAH
SCHEMBL1486690 0.81 MEN1 (0.39) TSHRMEN1KMT2ACYP3A4FAAH
SCHEMBL2003208 0.81 MEN1 (0.39) TSHRMEN1KMT2ACYP3A4FAAH
SCHEMBL28474387 0.81 MEN1 (0.39) TSHRMEN1KMT2ACYP3A4FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0589301-B1 Carboxynilides derivatives, process for their preparation and fungicidal compositions containing them BASF AG (DE) 2002-06-26 EP disclosed
US-5438070-A Agricultural fungicides BASF AKTIENGESELLSCHAFT (DE) 1995-08-01 US disclosed
EP-0591699-A1 N-hydroxy-N-phenylcarboxamides, processes for their production and agents containing them for the controlling of harmful fungi BASF Aktiengesellschaft (DE) 1994-04-13 EP disclosed
EP-0589313-A1 Cyclohex(en)ylcarboxamides, process for their preparation and anti-fungal agents containing them BASF Aktiengesellschaft (DE) 1994-03-30 EP disclosed
EP-0589301-A1 Carboxynilides derivatives, process for their preparation and fungicidal compositions containing them BASF Aktiengesellschaft (DE) 1994-03-30 EP disclosed