SCHEMBL9880112

SCHEMBL9880112

C=C(C)C(=O)OC1C2OC(=O)C3C(C)C1SC23

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL12977735 0.82 KDM4E (0.31) KDM4ENPC1POLBMAPTPKM
SCHEMBL13011235 0.79 — —
SCHEMBL74443 0.75 KDM4E (0.32) KDM4ENPC1POLBMAPTPKM
SCHEMBL685969 0.73 KDM4E (0.33) KDM4ENPC1POLBMAPTPKM
SCHEMBL19954374 0.73 KDM4E (0.33) KDM4ENPC1POLBMAPTPKM
SCHEMBL92291 0.72 KDM4E (0.30) KDM4ENPC1POLBMAPTPKM
SCHEMBL19215185 0.72 KDM4E (0.30) KDM4ENPC1POLBMAPTPKM
SCHEMBL12977740 0.71 — —
SCHEMBL18270550 0.70 KDM4E (0.34) KDM4ENPC1POLBMAPTPKM
SCHEMBL24533713 0.70 — —

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
US-8734904-B2 Methods of forming topographical features using segregating polymer mixtures INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-05-27 — — US disclosed
US-20120135146-A1 METHODS OF FORMING TOPOGRAPHICAL FEATURES USING SEGREGATING POLYMER MIXTURES JSR CORPORATION (JP) 2012-05-31 — — US disclosed
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