SCHEMBL7737220

SCHEMBL7737220

CC1CC1(C(N)=O)C(=O)Nc1cc(Cl)cc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 6/20 0.46
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
FADS1 O60427 1/20 0.37
IDO1 P14902 1/20 0.37
P2RY1 P47900 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
SCHEMBL11517722 0.80 MEN1 (0.46) GRM4MEN1KMT2AMAPTNPSR1
SCHEMBL307697 0.78 SLC6A2 (0.48) MEN1KMT2AMAPTPOLBSMN1; SMN2
SCHEMBL19373187 0.76 ALDH1A1 (0.50) MEN1KMT2APOLBRAB9ASMN1; SMN2
SCHEMBL29693415 0.76 ALDH1A1 (0.50) MEN1KMT2APOLBRAB9ASMN1; SMN2
SCHEMBL27362735 0.74 GRM4 (0.43) GRM4MEN1KMT2AMAPTNPSR1
SCHEMBL6393560 0.74 GRM4 (0.43) GRM4MEN1KMT2AMAPTNPSR1
SCHEMBL11259662 0.72 GRM4 (0.40) GRM4MEN1KMT2AMAPTNPSR1
SCHEMBL29577646 0.72 SMN1; SMN2 (0.60) MEN1KMT2AMAPTPOLBRAB9A
Bicarbonate SCHEMBL11403577 0.71 GRM4 (0.44) GRM4MEN1KMT2AMAPTNPSR1
Carbamic Acid SCHEMBL11363221 0.70 GRM4 (0.49) GRM4MEN1KMT2AMAPTNPSR1

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-6414031-B1 CONTROLLING FUNGI BASF AKTIENGESELLSCHAFT (DE) 2002-07-02 US disclosed