SCHEMBL13098203

SCHEMBL13098203

C=C(OOC(C)(C)C)Oc1ccc(C(c2ccccc2)c2ccc(OCC(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 3/20 0.44
▸ CNR1 P21554 1/20 0.43
▸ POLB P06746 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MAPT P10636 3/20 0.38
▸ FFAR1 O14842 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ PSEN1 P49768 2/20 0.36
▸ PSEN2 P49810 2/20 0.36
▸ APH1B Q8WW43 2/20 0.36
▸ NCSTN Q92542 2/20 0.36
▸ APH1A Q96BI3 2/20 0.36
▸ PSENEN Q9NZ42 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.35

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
SCHEMBL11917864 0.86 PTPN1 (0.54) PTPN1CNR1POLBL3MBTL1MEN1
SCHEMBL13005265 0.85 PTPN1 (0.41) PTPN1POLBL3MBTL1MEN1KMT2A
SCHEMBL12228667 0.82 PSEN1 (0.38) PTPN1CNR1POLBL3MBTL1MEN1
SCHEMBL13098233 0.82 PSEN1 (0.38) PTPN1CNR1POLBL3MBTL1MEN1
SCHEMBL8958894 0.81 CNR1 (0.53) PTPN1CNR1L3MBTL1MEN1KMT2A
SCHEMBL2448079 0.74 ALOX15 (0.57) PTPN1POLBMEN1KMT2AMAPT
SCHEMBL13098215 0.71 ELANE (0.58) L3MBTL1MEN1KMT2AMAPTFFAR1
SCHEMBL9772363 0.71 RAB9A (0.52) PTPN1CNR1POLBMEN1KMT2A
SCHEMBL22000631 0.71 MAPT (0.63) PTPN1POLBL3MBTL1KMT2AMAPT
SCHEMBL13098197 0.71 ELANE (0.58) L3MBTL1MEN1KMT2AMAPTFFAR1

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-20100255420-A1 RADIATION SENSITIVE RESIN COMPOSITION AND POLYMER JSR CORPORATION (JP) 2010-10-07 — — US disclosed
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