SCHEMBL730579

SCHEMBL730579

c1ccc2c(c1)ccc1nccnc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.61
LMNA P02545 4/20 0.59
ALDH1A1 P00352 4/20 0.46
TSHR P16473 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
CYP2A6 P11509 2/20 0.46
HSD17B10 Q99714 1/20 0.46
MAPT P10636 6/20 0.45
KDM4E B2RXH2 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
TP53 P04637 2/20 0.45
HPGD P15428 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
PMP22 Q01453 2/20 0.44
GMNN O75496 1/20 0.44
HSP90AA1 P07900 1/20 0.44
MMP2 P08253 1/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL31398339 1.00 CYP3A4 (0.61) CYP3A4LMNAALDH1A1TSHRTDP1
Fluoride SCHEMBL28088956 0.98 CYP3A4 (0.59) CYP3A4LMNAALDH1A1TSHRTDP1
SCHEMBL3195909 0.98 CYP3A4 (0.59) CYP3A4LMNAALDH1A1TSHRTDP1
Pyrazine SCHEMBL28784291 0.94 CYP3A4 (0.55) CYP3A4LMNAALDH1A1TSHRTDP1
SCHEMBL20042604 0.90 CYP3A4 (0.60) CYP3A4LMNAALDH1A1TSHRTDP1
SCHEMBL3076718 0.90 CYP3A4 (0.60) CYP3A4LMNAALDH1A1TSHRTDP1
Furan SCHEMBL28285323 0.89 CYP3A4 (0.50) CYP3A4LMNAALDH1A1TSHRTDP1
SCHEMBL6473780 0.88 CYP3A4 (0.49) CYP3A4LMNAALDH1A1TSHRTDP1
SCHEMBL28928285 0.86 CYP3A4 (0.51) CYP3A4LMNAALDH1A1TSHRTDP1
SCHEMBL20042609 0.86 CYP3A4 (0.55) CYP3A4LMNAALDH1A1TSHRTDP1

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

Appears in 2738 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3800677-B1 ORGANIC LIGHT-EMITTING DEVICE AND APPARATUS INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2026-05-06 EP claimed
US-20260076088-A1 LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE ORGANOMETALLIC COMPOUND SAMSUNG DISPLAY CO LTD (KR) 2026-03-12 US claimed
US-12568759-B2 Organic light-emitting device and display apparatus including the same SAMSUNG DISPLAY CO., LTD. (KR) 2026-03-03 US claimed
EP-3694012-B1 METHOD FOR PREPARING AN ORGANIC SEMICONDUCTING LAYER NOVALED GMBH (DE) 2026-02-11 EP claimed
US-20260040814-A1 LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE ORGANOMETALLIC COMPOUND SAMSUNG DISPLAY CO LTD (KR) 2026-02-05 US claimed
US-12534486-B2 Organometallic compound, organic light-emitting device including the same, and electronic apparatus including the organic light-emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2026-01-27 US claimed
US-20260020493-A1 LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE ORGANOMETALLIC COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2026-01-15 US claimed
US-20260007067-A1 LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE ORGANOMETALLIC COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2026-01-01 US claimed
US-20250386661-A1 LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE ORGANOMETALLIC COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2025-12-18 US claimed
US-12497560-B2 Organic light-emitting device and apparatus including organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2025-12-16 US claimed
US-20120248421-A1 LIGHT-EMITTING ELEMENT SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-10-04 US claimed
WO-2012132809-A1 LIGHT-EMITTING ELEMENT SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-10-04 WO claimed
EP-1778176-B1 COMPOSITION FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2012-07-25 EP claimed
EP-1730124-A4 CERTAIN TRIAZOLE-BASED COMPOUNDS, COMPOSITIONS, AND USES THEREOF AMPHORA DISCOVERY CORP (US) 2009-04-01 EP claimed
US-20080301885-A1 REVERSIBLY CHANGEABLE HAIR COLOR HENKEL AG & CO. KGAA (DE) 2008-12-11 US claimed
EP-1730124-A1 CERTAIN TRIAZOLE-BASED COMPOUNDS, COMPOSITIONS, AND USES THEREOF Amphora Discovery Corporation (US) 2006-12-13 EP claimed
US-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof AGRIUS GROUP, LLC. 2005-12-29 US claimed
WO-2005097758-A1 CERTAIN TRIAZOLE-BASED COMPOUNDS, COMPOSITIONS, AND USES THEREOF AMPHORA DISCOVERY CORPORATION (US) 2005-10-20 WO claimed
US-5756650-A COMPOSITION COMPRISING POLYAMIC ACID, CURE ACCELERATOR SELECTED FROM GROUP CONSISTING OF NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, AMINO ACID COMPOUND, AROMATIC COMPOUND HAVING TWO OR MORE HYDROXYL GROUPS KABUSHIKI KAISHA TOSHIBA (JP) 1998-05-26 US claimed
US-5498549-A A FLUORESCENT POLYNUCLEAR COMPOUND COVALENTLY BONDED TO A POLYSILOXANE MATRIX, BLOOD GASES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-03-12 US claimed