SCHEMBL7547693

SCHEMBL7547693

CCCCC=CC([O])CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.40
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
CYP3A4 P08684 2/20 0.38
FAAH O00519 2/20 0.38
TRPV1 Q8NER1 2/20 0.38
SPHK2 Q9NRA0 4/20 0.38
SPHK1 Q9NYA1 4/20 0.38
CETP P11597 3/20 0.38
F7 P08709 1/20 0.38
F3 P13726 1/20 0.38
ALDH1A1 P00352 4/20 0.36
MAPT P10636 3/20 0.36
GMNN O75496 2/20 0.36
LMNA P02545 2/20 0.36
GLA P06280 2/20 0.36
POLB P06746 2/20 0.36
THRB P10828 2/20 0.36
MAPK1 P28482 2/20 0.36
CXCR5 P32302 2/20 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
SCHEMBL7547691 1.00 TSHR (0.40) TSHRMEN1KMT2ACYP3A4FAAH
SCHEMBL7547708 0.93 FAAH (0.46) TSHRMEN1KMT2ACYP3A4FAAH
SCHEMBL7547706 0.93 FAAH (0.46) TSHRMEN1KMT2ACYP3A4FAAH
SCHEMBL7554580 0.85
SCHEMBL7554584 0.85
SCHEMBL8780398 0.84 TSHR (0.39) TSHRMEN1KMT2ACYP3A4FAAH
SCHEMBL8780402 0.84 TSHR (0.39) TSHRMEN1KMT2ACYP3A4FAAH
SCHEMBL7550135 0.78
SCHEMBL7550132 0.78
SCHEMBL11283033 0.76 MEN1 (0.38) 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-0589301-A1 Carboxynilides derivatives, process for their preparation and fungicidal compositions containing them BASF Aktiengesellschaft (DE) 1994-03-30 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