SCHEMBL10956573

SCHEMBL10956573

CCCCCCCCCCCCC1=C(Cl)C(=O)c2ccccc2C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.54
IDO1 P14902 1/20 0.48
DNMT1 P26358 1/20 0.48
DNMT3L Q9UJW3 1/20 0.48
DNMT3A Q9Y6K1 1/20 0.48
MITF O75030 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
SOAT1 P35610 8/20 0.43
TDP2 O95551 1/20 0.43
PAX8 Q06710 1/20 0.43
HKDC1 Q2TB90 1/20 0.43
TLR9 Q9NR96 1/20 0.43

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
SCHEMBL10954496 1.00 PTPN1 (0.54) PTPN1IDO1DNMT1DNMT3LDNMT3A
SCHEMBL9627508 1.00 PTPN1 (0.54) PTPN1IDO1DNMT1DNMT3LDNMT3A
SCHEMBL9627850 0.98 PTPN1 (0.51) PTPN1IDO1DNMT1DNMT3LDNMT3A
SCHEMBL10953110 0.93 IDO1 (0.52) PTPN1IDO1DNMT1DNMT3LDNMT3A
SCHEMBL9628338 0.86 MAPT (0.56) PTPN1IDO1DNMT1DNMT3LDNMT3A
SCHEMBL9627893 0.83 MAOA (0.45) PTPN1ALDH1A1MAPTTDP1USP2
SCHEMBL7792780 0.81 IDO1 (0.50) IDO1DNMT1DNMT3LDNMT3AMITF
SCHEMBL571607 0.81 ALDH1A1 (0.58) PTPN1MITFALDH1A1MAPTTDP1
SCHEMBL571286 0.81 ALDH1A1 (0.58) PTPN1MITFALDH1A1MAPTTDP1
SCHEMBL15695046 0.81 ALDH1A1 (0.58) PTPN1MITFALDH1A1MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4507241-A Method for the hydrocarbylation of naphthoquinone derivatives E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-03-26 US disclosed
US-4120897-A 2-Alkyl-1-naphthol-4-sulfonic acids E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-10-17 US disclosed
US-4110473-A MITICIDAL ETHERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-08-29 US disclosed
US-4049705-A 2-Alkyl-1-naphthol-4-sulfonic acids E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-09-20 US disclosed