SCHEMBL4848747

SCHEMBL4848747

c1cc2cccc3c4ccc5c6cccc7cccc(c8ccc(c(c1)c23)c4c85)c76

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.63
HSD17B10 Q99714 7/20 0.63
CYP1A2 P05177 5/20 0.63
HPGD P15428 5/20 0.63
THRB P10828 1/20 0.63
ERBB2 P04626 1/20 0.54
FYN P06241 1/20 0.54
MAOA P21397 1/20 0.54
ACHE P22303 1/20 0.54
AHR P35869 1/20 0.54
TSHR P16473 7/20 0.53
CYP3A4 P08684 4/20 0.53
CYP1A1 P04798 1/20 0.53
CYP1B1 Q16678 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
HPRT1 P00492 1/20 0.45
MAPK1 P28482 2/20 0.43
ATM Q13315 1/20 0.43
CASP1 P29466 1/20 0.42

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
SCHEMBL29105767 1.00 ALDH1A1 (0.63) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL29369890 1.00 ALDH1A1 (0.63) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL29354688 1.00 ALDH1A1 (0.63) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL347568 0.97 ALDH1A1 (0.60) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4501676 0.93 ALDH1A1 (0.63) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL6538859 0.93 ALDH1A1 (0.71) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL634848 0.93 ALDH1A1 (0.71) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL26440 0.93 ALDH1A1 (0.71) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL29906043 0.93 ALDH1A1 (0.71) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4851746 0.91 ALDH1A1 (0.62) ALDH1A1HSD17B10CYP1A2HPGDTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4674238-A1 HOLE-SELECTIVE CONTACT MATERIAL, PHOTOELECTRIC CONVERSION DEVICE AND POLYCYCLIC AROMATIC HYDROCARBON COMPOUND Okinawa Institute of Science and Technology School Corporation (JP) 2026-01-07 EP disclosed
WO-2024181467-A1 HOLE-SELECTIVE CONTACT MATERIAL, PHOTOELECTRIC CONVERSION DEVICE AND POLYCYCLIC AROMATIC HYDROCARBON COMPOUND OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2024-09-06 WO disclosed
US-7470290-B2 Hydroscopic polymer gels for easier cleaning THE CLOROX COMPANY (US) 2008-12-30 US disclosed
US-7183010-B2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CORPORATION (US) 2007-02-27 US disclosed
US-20050245428-A1 Hydroscopic polymer gels for easier cleaning RODRIGUES KLIN A 2005-11-03 US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed