SCHEMBL8076691

SCHEMBL8076691

OCCc1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccc(-c6ccc(CCO)cc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.56
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
FFAR1 O14842 1/20 0.44
CA2 P00918 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MMP12 P39900 5/20 0.40
MAPKAPK2 P49137 1/20 0.39
CNR2 P34972 1/20 0.39
MMP13 P45452 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TAAR1 Q96RJ0 2/20 0.38

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
SCHEMBL279127 1.00 TDP1 (0.56) TDP1MEN1KMT2AFFAR1CA2
SCHEMBL2312474 1.00 TDP1 (0.56) TDP1MEN1KMT2AFFAR1CA2
SCHEMBL13992396 0.96 TDP1 (0.56) TDP1MEN1KMT2AFFAR1CA2
SCHEMBL12960557 0.96 TDP1 (0.56) TDP1MEN1KMT2AFFAR1CA2
SCHEMBL13992398 0.96 TDP1 (0.56) TDP1MEN1KMT2AFFAR1CA2
SCHEMBL14371523 0.94 TDP1 (0.62) TDP1MEN1KMT2AFFAR1CA2
SCHEMBL11119430 0.94 TDP1 (0.62) TDP1MEN1KMT2AFFAR1CA2
SCHEMBL21303703 0.87 MEN1 (0.58) TDP1MEN1KMT2ACA2KDM4E
SCHEMBL12679110 0.86 CA2 (0.45) TDP1MEN1KMT2AFFAR1CA2
SCHEMBL8177188 0.86 TDP1 (0.48) TDP1MEN1KMT2AFFAR1KDM4E

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-0711289-B1 PIPERAZINE COMPOUNDS USED IN THERAPY DELTA PHARMACEUTICALS INC (US) 2000-08-23 EP disclosed
EP-0710893-B1 Charge transporting polymer, process for producing the same, and electrophotographic photoreceptor containing the same FUJI XEROX CO LTD (JP) 2000-08-23 EP disclosed
US-5681830-A DIARYLMETHYL PIPERAZINE COMPOUNDS HAVING UTILITY IN MEDICAL THERAPY AS RECEPTOR-BINDING SPECIES DELTA PHARMACEUTICALS, INC. (US) 1997-10-28 US disclosed
US-5639581-A ELECTROPHOTOGRAPHIC PHOTORECEPTOR FUJI XEROX CO., LTD. (JP) 1997-06-17 US disclosed
US-5574159-A DIARYLMETHYL PIPERAZINES, RECEPTOR BINDING DELTA PHARMACEUTICALS, INC. (US) 1996-11-12 US disclosed
US-5552404-A COMPOUNDS FOR NEUROTRANSMITTERS FOR ANIMALS DELTA PHARMACEUTICALS, INC. (US) 1996-09-03 US disclosed
EP-0711289-A1 PIPERAZINE COMPOUNDS USED IN THERAPY DELTA PHARMACEUTICALS, INC. (US) 1996-05-15 EP disclosed
EP-0710893-A1 Charge transporting polymer, process for producing the same, and organic electronic device containing the same FUJI XEROX CO., LTD. (JP) 1996-05-08 EP disclosed
WO-1996011927-A1 ENDOTHELIN ANTAGONISTS ABBOTT LABORATORIES (US) 1996-04-25 WO disclosed
US-5475106-A Agonist for cholecystokinin and gastrin receptors; nervous system, gastrointestinal disorders RHONE-POULENC RORER S.A. (FR) 1995-12-12 US disclosed
WO-1995004051-A1 PIPERAZINE COMPOUNDS USED IN THERAPY THE WELLCOME FOUNDATION LIMITED (GB) 1995-02-09 WO disclosed
US-5382590-A Gastrointestinal disorders and nervous system disorders RHONE-POULENC RORER S.A. (FR) 1995-01-17 US disclosed