SCHEMBL15082575

SCHEMBL15082575

COc1c2ccccc2c(OC)c2cc(C(OC(=O)N3CCCCC3)c3ccccc3)ccc12

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 4/20 0.44
▸ KMT2A Q03164 5/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ HPGD P15428 2/20 0.41
▸ RAB9A P51151 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.38
▸ LMNA P02545 3/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ HTR1D P28221 1/20 0.38
▸ HTR2B P41595 1/20 0.38
▸ TDP1 Q9NUW8 3/20 0.38
▸ GAA P10253 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ L3MBTL1 Q9Y468 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
SCHEMBL15082586 0.88 GAA (0.45) NPSR1KMT2AMEN1MAPTCYP1A2
SCHEMBL15082565 0.86 NPSR1 (0.45) NPSR1KMT2AMEN1MAPTCYP1A2
SCHEMBL15082574 0.83 NPSR1 (0.43) NPSR1KMT2AMEN1MAPTCYP1A2
SCHEMBL15082583 0.74 NPSR1 (0.43) NPSR1KMT2AMEN1MAPTCYP1A2
SCHEMBL27518463 0.74 MGLL (0.53) NPSR1KMT2AMEN1MAPTCYP1A2
SCHEMBL15082584 0.73 GAA (0.43) NPSR1KMT2AMEN1MAPTCYP1A2
SCHEMBL15082557 0.73 NPSR1 (0.46) NPSR1KMT2AMEN1MAPTCYP1A2
SCHEMBL15082567 0.73 NPSR1 (0.46) NPSR1KMT2AMEN1MAPTCYP1A2
SCHEMBL15082572 0.72 NPSR1 (0.45) NPSR1KMT2AMEN1MAPTCYP1A2
SCHEMBL15082559 0.72 HPGD (0.42) NPSR1KMT2AMEN1MAPTCYP1A2

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 2 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
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