SCHEMBL13864948

SCHEMBL13864948

COC(=O)c1cc(Br)c(C(=O)Oc2c(C)cc(C(c3cc(C)c(C)c(C)c3)(C(F)(F)F)C(F)(F)F)cc2C)cc1Br

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 1/20 0.40
▸ KMT2A Q03164 2/20 0.36
▸ NOTUM Q6P988 3/20 0.36
▸ CFTR P13569 2/20 0.35
▸ POLB P06746 2/20 0.35
▸ PTPN1 P18031 2/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ PTGES O14684 1/20 0.32
▸ ACHE P22303 1/20 0.31
▸ MAPT P10636 2/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ USP2 O75604 1/20 0.30

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
SCHEMBL13864932 0.88 CFTR (0.38) SOS1KMT2ANOTUMCFTRPOLB
SCHEMBL13864978 0.82 CFTR (0.39) KMT2ACFTRPOLBMAPTMEN1
SCHEMBL13864933 0.80 TDP1 (0.44) KMT2ANOTUMMAPT
SCHEMBL13864956 0.78 CFTR (0.38) SOS1KMT2ANOTUMCFTRMAPT
SCHEMBL13864946 0.78 KMT2A (0.40) SOS1KMT2ANOTUMCFTRCYP3A4
SCHEMBL13865019 0.77 NOTUM (0.40) KMT2ANOTUMPOLBMAPTMEN1
SCHEMBL13864945 0.76 NOTUM (0.43) KMT2ANOTUMCFTRPOLBMAPT
SCHEMBL197110 0.72 SOS1 (0.50) SOS1KMT2ANOTUMCFTRPOLB
SCHEMBL2538919 0.70 KMT2A (0.44) SOS1KMT2ANOTUMCFTRCYP3A4
SCHEMBL20036871 0.70 KMT2A (0.44) SOS1KMT2ANOTUMCFTRCYP3A4

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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