SCHEMBL13864932

SCHEMBL13864932

COC(=O)c1cc(C)c(C(=O)Oc2c(C)cc(C(c3cc(C)c(C)c(C)c3)(C(F)(F)F)C(F)(F)F)cc2C)cc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 2/20 0.38
▸ POLB P06746 2/20 0.37
▸ NOTUM Q6P988 3/20 0.35
▸ CYP3A4 P08684 3/20 0.34
▸ PTGES O14684 1/20 0.34
▸ PTPN1 P18031 1/20 0.34
▸ PDGFRB P09619 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ PDGFRA P16234 1/20 0.33
▸ FLT1 P17948 1/20 0.33
▸ FGFR3 P22607 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ MAPT P10636 5/20 0.32
▸ SOS1 Q07889 1/20 0.32
▸ ALDH1A1 P00352 4/20 0.32
▸ HPGD P15428 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ GLA P06280 1/20 0.32
▸ GAA P10253 1/20 0.32

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
SCHEMBL13864948 0.88 SOS1 (0.40) CFTRPOLBNOTUMCYP3A4PTGES
SCHEMBL13864933 0.86 TDP1 (0.44) NOTUMMAPTALDH1A1GAAKMT2A
SCHEMBL13864978 0.86 CFTR (0.39) CFTRPOLBMAPTALDH1A1HPGD
SCHEMBL13864945 0.81 NOTUM (0.43) CFTRPOLBNOTUMMAPTALDH1A1
SCHEMBL13865019 0.80 NOTUM (0.40) POLBNOTUMMAPTALDH1A1KMT2A
SCHEMBL13864955 0.77 ALDH1A1 (0.42) CFTRPOLBCYP3A4MAPTALDH1A1
SCHEMBL13864930 0.76 CFTR (0.40) CFTRNOTUMMAPTALDH1A1HPGD
SCHEMBL9127431 0.73 RXRB (0.41) POLBNOTUMALDH1A1HPGDKDM4E
SCHEMBL2430255 0.73 KDM4E (0.50) CFTRPOLBCYP3A4PDGFRBFGFR1
SCHEMBL9891111 0.71 ESR1 (0.39) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090123854-A1 IMAGE FORMING METHOD KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2009-05-14 — — US disclosed
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