SCHEMBL2444985

SCHEMBL2444985

CCCc1cc(C2(c3ccc(Oc4ccc(N)cc4)c(CCC)c3)c3ccccc3-c3ccccc32)ccc1Oc1ccc(N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
OPRK1 P41145 1/20 0.50
NCOA1 Q15788 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
HRH1 P35367 1/20 0.35
AR P10275 1/20 0.34
MAOA P21397 1/20 0.34
PKM P14618 1/20 0.34
PDK2 Q15119 3/20 0.33
HTR2A P28223 1/20 0.33
SLC6A4 P31645 1/20 0.33
PPARG P37231 2/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL2439548 0.93 KDM4E (0.50) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL2444089 0.90 MEN1 (0.53) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL2441683 0.90 KDM4E (0.49) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL2443557 0.87 MEN1 (0.46) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL2441121 0.87 MEN1 (0.46) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL2439562 0.86 SMN1; SMN2 (0.48) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL29418399 0.86 KDM4E (0.44) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL2441622 0.86 KDM4E (0.44) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL2442284 0.84 KDM4E (0.46) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL2447745 0.83 ESR1 (0.45) MEN1KMT2AMAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2128193-B1 POROUS POLYIMIDE IBIDEN CO LTD (JP) 2013-06-19 EP disclosed
US-8022110-B2 Porous polyimide IBIDEN CO., LTD. (JP) 2011-09-20 US disclosed
US-20100048745-A1 POROUS POLYIMIDE IBIDEN CO., LTD (JP) 2010-02-25 US disclosed
EP-2128193-A1 POROUS POLYIMIDE Ibiden Co., Ltd. (JP) 2009-12-02 EP disclosed