SCHEMBL15082585

SCHEMBL15082585

CCOc1c2ccccc2c(OCC)c2cc(COC(=O)N3CCCCC3)ccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.45
▸ ALDH1A1 P00352 5/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ RAB9A P51151 4/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ NPC1 O15118 3/20 0.45
▸ NPSR1 Q6W5P4 3/20 0.44
▸ TP53 P04637 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ GAA P10253 4/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HTT P42858 2/20 0.41
▸ GRIN2B Q13224 1/20 0.41
▸ TSHR P16473 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ PTGER4 P35408 1/20 0.41

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
SCHEMBL15082578 0.91 NPSR1 (0.43) SMN1; SMN2ALDH1A1KMT2ARAB9AMEN1
SCHEMBL15082558 0.90 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1KMT2ARAB9AMEN1
SCHEMBL15082581 0.89 NPSR1 (0.41) SMN1; SMN2ALDH1A1KMT2ARAB9AMEN1
SCHEMBL15082587 0.89 NPSR1 (0.43) SMN1; SMN2ALDH1A1KMT2ARAB9AMEN1
SCHEMBL15082557 0.88 NPSR1 (0.46) SMN1; SMN2ALDH1A1KMT2ARAB9AMEN1
SCHEMBL15082567 0.88 NPSR1 (0.46) SMN1; SMN2ALDH1A1KMT2ARAB9AMEN1
SCHEMBL15082589 0.87 GRIN2B (0.40) SMN1; SMN2ALDH1A1KMT2ARAB9AMEN1
SCHEMBL15082564 0.87 MEN1 (0.45) SMN1; SMN2ALDH1A1KMT2ARAB9AMEN1
SCHEMBL15082579 0.86 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1KMT2ARAB9AMEN1
SCHEMBL15082580 0.85 NPSR1 (0.44) SMN1; SMN2KMT2ARAB9AMEN1NPC1

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
EP-2615633-A1 COMPOSITION FOR WATER-REPELLENT TREATMENT OF SURFACE, AND METHOD FOR WATER-REPELLENT TREATMENT OF SURFACE OF SEMICONDUCTOR SUBSTRATE USING SAME Wako Pure Chemical Industries, Ltd. (JP) 2013-07-17 — — EP disclosed
US-20130171835-A1 COMPOSITION FOR WATER-REPELLENT TREATMENT OF SURFACE, AND METHOD FOR WATER-REPELLENT TREATMENT OF SURFACE OF SEMICONDUCTOR SUBSTRATE USING SAME WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2013-07-04 — — US disclosed
US-20130171835-A1 COMPOSITION FOR WATER-REPELLENT TREATMENT OF SURFACE, AND METHOD FOR WATER-REPELLENT TREATMENT OF SURFACE OF SEMICONDUCTOR SUBSTRATE USING SAME WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2013-07-04 — — US disclosed
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