SCHEMBL1966744

SCHEMBL1966744

C=Cc1ccc2c([nH]c3ccccc32)c1-c1ccccc1C=CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 7/20 0.40
PIM1 P11309 2/20 0.40
PIM3 Q86V86 2/20 0.40
PIM2 Q9P1W9 1/20 0.40
PTGER1 P34995 1/20 0.38
PTGER3 P43115 1/20 0.38
PTGER2 P43116 1/20 0.38
NFKB1 P19838 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPC1 O15118 3/20 0.36
MAPT P10636 3/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
NFKB2 Q00653 1/20 0.36

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
SCHEMBL9502084 0.82 PIM3 (0.44) PARP14PIM1PIM3PIM2NFKB1
SCHEMBL1871961 0.78 PARP1 (0.49) PARP14PIM1PIM3PIM2NFKB1
Pavettine SCHEMBL1966741 0.78 HDAC1 (0.49) PARP14PIM1PIM3PIM2PTGER3
SCHEMBL1754392 0.76 ESR1 (0.46) PIM1PIM3PIM2MEN1KMT2A
SCHEMBL3995371 0.73 CA1 (0.56) PTGER1PTGER3PTGER2NFKB1CA1
SCHEMBL31531013 0.73 PARP14 (0.52) PARP14NFKB1MEN1KMT2ANPC1
SCHEMBL175543 0.72 NFKB1 (0.62) PTGER1PTGER3PTGER2NFKB1CA1
SCHEMBL9817843 0.72 NFKB1 (0.62) PTGER1PTGER3PTGER2NFKB1CA1
SCHEMBL28450606 0.71 PARP14 (0.55) PARP14NFKB1MEN1KMT2ANPC1
SCHEMBL27574548 0.70 MEN1 (0.54) PIM1PIM3PIM2NFKB1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2335299-B1 DERIVATIZED FULLERENE-BASED DOPANTS FOR ORGANIC SEMICONDUCTORS TECHNION RES & DEV FOUNDATION (IL) 2018-01-10 EP claimed
CN-102217110-B Derivatized fullerene-based dopants for organic semiconductors TECHNION RES & DEV FOUNDATION 2014-06-04 CN claimed
CN-102217110-A Derivatized fullerene-based dopants for organic semiconductors TECHNION RES & DEV FOUNDATION 2011-10-12 CN claimed
EP-2335299-A1 DERIVATIZED FULLERENE-BASED DOPANTS FOR ORGANIC SEMICONDUCTORS Technion Research and Development Foundation, Ltd. (IL) 2011-06-22 EP claimed
WO-2010029542-A1 DERIVATIZED FULLERENE-BASED DOPANTS FOR ORGANIC SEMICONDUCTORS TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2010-03-18 WO claimed
EP-2335299-B1 DERIVATIZED FULLERENE-BASED DOPANTS FOR ORGANIC SEMICONDUCTORS TECHNION RES & DEV FOUNDATION (IL) 2018-01-10 EP disclosed
CN-102217110-B Derivatized fullerene-based dopants for organic semiconductors TECHNION RES & DEV FOUNDATION 2014-06-04 CN disclosed
US-8431434-B2 Derivatized fullerene-based dopants for organic semiconductors TECHNION RESEARCH & DEVELOPMENT FOUNDATION LIMITED (IL) 2013-04-30 US disclosed
CN-102217110-A Derivatized fullerene-based dopants for organic semiconductors TECHNION RES & DEV FOUNDATION 2011-10-12 CN disclosed
US-20110156019-A1 DERIVATIZED FULLERENE-BASED DOPANTS FOR ORGANIC SEMICONDUCTORS TECHNION RESEARCH & DEVELOPMENT FOUNDATION, LTD. (IL) 2011-06-30 US disclosed
EP-2335299-A1 DERIVATIZED FULLERENE-BASED DOPANTS FOR ORGANIC SEMICONDUCTORS Technion Research and Development Foundation, Ltd. (IL) 2011-06-22 EP disclosed
WO-2010029542-A1 DERIVATIZED FULLERENE-BASED DOPANTS FOR ORGANIC SEMICONDUCTORS TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2010-03-18 WO disclosed