SCHEMBL29958044

SCHEMBL29958044

O=Cc1coc2cc(Cl)ccc2c1=O

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 13/20 0.77
PTPN2 P17706 2/20 0.61
MAOA P21397 5/20 0.60
MAOB P27338 5/20 0.60
ALDH1A1 P00352 2/20 0.58
GAA P10253 1/20 0.58
MAPT P10636 1/20 0.58
POLB P06746 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL358642 0.88 PTPN1 (0.63) PTPN1PTPN2MAOAMAOBALDH1A1
SCHEMBL5363245 0.87 PTPN1 (1.00) PTPN1PTPN2MAOAMAOBALDH1A1
SCHEMBL7025708 0.83 PTPN1 (0.86) PTPN1PTPN2MAOAMAOBALDH1A1
SCHEMBL29956322 0.80 PTPN1 (0.61) PTPN1PTPN2MAOAMAOBALDH1A1
SCHEMBL29529294 0.80 PTPN1 (0.77) PTPN1PTPN2MAOAMAOBALDH1A1
SCHEMBL19182133 0.80 PTPN1 (0.77) PTPN1PTPN2MAOAMAOBALDH1A1
SCHEMBL29954829 0.80 PTPN1 (0.61) PTPN1PTPN2MAOAMAOBALDH1A1
SCHEMBL1861100 0.80 PTPN1 (0.61) PTPN1PTPN2MAOAMAOBALDH1A1
SCHEMBL28564467 0.80 PTPN1 (0.77) PTPN1PTPN2MAOAMAOBALDH1A1
SCHEMBL29952901 0.79 PTPN1 (0.77) PTPN1PTPN2MAOAMAOBALDH1A1

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed