SCHEMBL9435965

SCHEMBL9435965

CCCCCCc1cnc(-c2ccc(OCc3ccc(CCCCC)cc3)cc2)nc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.63
▸ MAPT P10636 4/20 0.63
▸ SMN1; SMN2 Q16637 4/20 0.63
▸ HSD17B10 Q99714 4/20 0.63
▸ KDM4E B2RXH2 3/20 0.63
▸ ALDH1A1 P00352 3/20 0.63
▸ MEN1 O00255 2/20 0.63
▸ USP2 O75604 2/20 0.63
▸ KMT2A Q03164 2/20 0.63
▸ GAA P10253 1/20 0.63
▸ HPGD P15428 1/20 0.63
▸ RARB P10826 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ CASP3 P42574 1/20 0.52
▸ SENP8 Q96LD8 1/20 0.52
▸ SENP7 Q9BQF6 1/20 0.52
▸ SENP6 Q9GZR1 1/20 0.52
▸ HRH3 Q9Y5N1 2/20 0.52
▸ NPC1 O15118 4/20 0.51
▸ STAT3 P40763 1/20 0.50

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
SCHEMBL10691018 1.00 RAB9A (0.63) RAB9AMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL9436020 1.00 RAB9A (0.63) RAB9AMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL10689666 1.00 RAB9A (0.63) RAB9AMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL10693841 1.00 RAB9A (0.63) RAB9AMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL10688442 1.00 RAB9A (0.63) RAB9AMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL10695346 1.00 RAB9A (0.63) RAB9AMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL10693145 1.00 RAB9A (0.63) RAB9AMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL10688250 1.00 RAB9A (0.63) RAB9AMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL10687921 1.00 RAB9A (0.63) RAB9AMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL9435687 1.00 RAB9A (0.63) RAB9AMAPTSMN1; SMN2HSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0233267-B1 SMECTIC CRYSTAL PHASES MERCK PATENT GMBH (DE) 1994-08-03 — — EP disclosed
EP-0238576-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS MERCK PATENT GmbH (DE) 1992-05-06 — — EP disclosed
US-5075032-A Electrooptics, switches, displays MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-12-24 — — US disclosed
US-5055221-A Rapidly switching ferroelectric display element MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-10-08 — — US disclosed
US-5002694-A Nitrogen-containing heterocyclic compounds MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-03-26 — — US disclosed
EP-0227717-B1 NITROGEN-CONTAINING HETEROCYCLIC ESTERS MERCK PATENT GmbH (DE) 1990-04-25 — — EP disclosed
EP-0224579-B1 SMECTIC LIQUID CRYSTALLINE PHASES MERCK PATENT GmbH (DE) 1990-01-24 — — EP disclosed
US-4886620-A Smectic liquid-crystalline phases MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-12-12 — — US disclosed
EP-0199004-B1 PYRIMIDINE DERIVATIVES MERCK PATENT GmbH (DE) 1989-09-06 — — EP disclosed
US-4820839-A LIQUID CRYSTALS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-04-11 — — US disclosed
US-4776973-A LIQUID CRYSTAL ELECTROOPTICS DISPLAY DEVICE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-10-11 — — US disclosed
EP-0233267-A1 SMECTIC CRYSTAL PHASES. MERCK PATENT GMBH (DE) 1987-08-26 — — EP disclosed
EP-0227717-A1 NITROGEN-CONTAINING HETEROCYCLIC ESTERS. MERCK PATENT GMBH (DE) 1987-07-08 — — EP disclosed
EP-0226592-A1 LIQUID CRYSTAL PHASE. MERCK PATENT GMBH (DE) 1987-07-01 — — EP disclosed
EP-0224579-A1 SMECTIC LIQUID CRYSTALLINE PHASES. MERCK PATENT GMBH (DE) 1987-06-10 — — EP disclosed
WO-1987001717-A2 SMECTIC CYSTAL PHASES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-03-26 — — WO disclosed
WO-1986007055-A1 NITROGEN-CONTAINING HETEROCYCLIC ESTERS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-12-04 — — WO disclosed
WO-1986007085-A1 SMECTIC LIQUID CRYSTALLINE PHASES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-12-04 — — WO disclosed
EP-0199004-A1 Pyrimidine derivatives MERCK PATENT GmbH (DE) 1986-10-29 — — EP disclosed
WO-1986005799-A1 LIQUID CRYSTAL PHASE MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-10-09 — — WO disclosed
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