SCHEMBL9323313

SCHEMBL9323313

O=C(O)c1cc(CCO)c(CCO)c(CCO)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.41
▸ CA12 O43570 2/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA7 P43166 2/20 0.39
▸ CA9 Q16790 2/20 0.39
▸ CA14 Q9ULX7 2/20 0.39
▸ TPMT P51580 3/20 0.38
▸ TP53 P04637 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ CA3 P07451 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ SELL P14151 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SELP P16109 1/20 0.38
▸ FUT4 P22083 1/20 0.38
▸ CA4 P22748 1/20 0.38
▸ CA6 P23280 1/20 0.38
▸ DPP4 P27487 1/20 0.38

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
SCHEMBL10634235 0.83 TPMT (0.40) ALDH1A1CA12CA1CA2CA7
SCHEMBL27885537 0.77 TSHR (0.44) ALDH1A1CA12CA1CA2CA7
SCHEMBL7050923 0.77 TPMT (0.46) ALDH1A1CA12CA1CA2CA7
SCHEMBL1073276 0.75 KDM4E (0.47) ALDH1A1CA12CA1CA2CA7
SCHEMBL11061807 0.74 RARB (0.47) ALDH1A1TPMTMAPTHPGDMAPK1
SCHEMBL27796759 0.74 HDAC1 (0.41) ALDH1A1CA12CA1CA2CA7
SCHEMBL9189349 0.73 CYP4F2 (0.43) ALDH1A1CA12CA1CA2CA7
SCHEMBL5695198 0.73 CYP4F2 (0.43) ALDH1A1CA12CA1CA2CA7
SCHEMBL1237714 0.73 TPMT (0.46) ALDH1A1CA12CA1CA2CA7
SCHEMBL2234436 0.72 FOLH1 (0.44) ALDH1A1CA12CA1CA2CA7

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-5316885-A THERMAL TRANSFER PRINTING KAO CORPORATION (JP) 1994-05-31 — — US disclosed
EP-0472106-B1 Pulverulent ink and printing methods KAO CORP (JP) 1994-02-16 — — EP disclosed
EP-0472106-A2 Pulverulent ink and printing methods KAO CORPORATION (JP) 1992-02-26 — — EP disclosed
Send feedback