SCHEMBL9713644

SCHEMBL9713644

CCCCOC1=CC(=O)c2cc(Sc3ccccc3CC)ccc2C1=O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.37
CDC25B P30305 2/20 0.36
PTPRC P08575 1/20 0.36
SOAT1 P35610 10/20 0.36
S100A4 P26447 1/20 0.36
IDO1 P14902 1/20 0.35
CDC25A P30304 1/20 0.35
GAPDH P04406 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
S1PR1 P21453 3/20 0.33
S1PR2 O95136 1/20 0.33
S1PR3 Q99500 1/20 0.33
LPAR2 Q9HBW0 1/20 0.33

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
SCHEMBL9642365 0.85 MAPT (0.39) PTPN1MEN1POLBKMT2AS1PR1
SCHEMBL9713331 0.79 SLC6A4 (0.39) SOAT1S100A4
SCHEMBL9713222 0.78 PTPN1 (0.38) PTPN1CDC25BPTPRCSOAT1S100A4
SCHEMBL9628020 0.76 CDC25B (0.59) PTPN1CDC25BPTPRCSOAT1S100A4
SCHEMBL9714218 0.76 NPC1 (0.36) PTPN1SOAT1
SCHEMBL9643210 0.73 ALDH1A1 (0.40) PTPN1CDC25BPTPRCS100A4IDO1
SCHEMBL9444193 0.72 CDC25B (0.57) PTPN1CDC25BPTPRCSOAT1S100A4
Naphthoquinone SCHEMBL28157298 0.72 CDC25B (0.53) PTPN1CDC25BPTPRCSOAT1S100A4
SCHEMBL11247136 0.71 CDC25B (0.56) PTPN1CDC25BPTPRCSOAT1S100A4
SCHEMBL9628579 0.71 CDC25B (0.56) PTPN1CDC25BPTPRCSOAT1S100A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5091558-A Topical administeration SYNTEX (U.S.A.) INC. (US) 1992-02-25 US disclosed
EP-0150831-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-10 EP disclosed
EP-0150831-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1985-08-07 EP disclosed