SCHEMBL50690

SCHEMBL50690

C1=CC2CCCc3ccc4cccc1c4c32

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32

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
SCHEMBL30365719 1.00 ADRA2A (0.36) ADRA2AADRA2BADRA2CCYP3A4TSHR
SCHEMBL29352264 1.00 ADRA2A (0.36) ADRA2AADRA2BADRA2CCYP3A4TSHR
Hydrochloric Acid SCHEMBL28386300 0.98 ADRA2A (0.35) ADRA2AADRA2BADRA2CCYP3A4TSHR
SCHEMBL10490504 0.93 ADRA2A (0.33) ADRA2AADRA2BADRA2C
SCHEMBL20209401 0.91 CYP1A2 (0.35) ADRA2AADRA2BADRA2CCYP3A4TSHR
SCHEMBL5175022 0.87
SCHEMBL10416022 0.84 BCHE (0.33)
SCHEMBL5397574 0.84 ADRA2A (0.36) ADRA2AADRA2BADRA2CCYP1A2CYP2D6
SCHEMBL417512 0.77 CYP3A4 (0.30) CYP3A4TSHR
SCHEMBL29941657 0.76 ADRA2A (0.38) ADRA2AADRA2BADRA2CTSHRCYP1A2

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 3579 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4638397-A1 METHOD FOR PREPARING DEUTERATED AROMATIC COMPOUNDS Merck Patent GmbH (DE) 2025-10-29 EP claimed
WO-2025132547-A1 MECHANOCHEMICAL METHOD FOR DEUTERATING ORGANIC COMPOUNDS MERCK PATENT GMBH (DE) 2025-06-26 WO claimed
US-20240400893-A1 WATER-SOLUBLE TETRAHYDROPYRENE BASED FLUORESCENT POLYMERS BECKMAN COULTER, INC. 2024-12-05 US claimed
US-20240360319-A1 SUBSTITUTED POLYFLUORENE COMPOUNDS BioLegend, Inc. 2024-10-31 US claimed
US-12091554-B2 Substituted polyfluorene compounds BioLegend, Inc. (US) 2024-09-17 US claimed
CN-118561233-A Liquid hydrogen storage composition and preparation method thereof 武汉氢阳能源有限公司 2024-08-30 CN claimed
WO-2024133048-A1 METHOD FOR PREPARING DEUTERATED AROMATIC COMPOUNDS MERCK PATENT GMBH (DE) 2024-06-27 WO claimed
WO-2024044327-A1 DHNT MONOMERS AND POLYMER DYES WITH MODIFIED PHOTOPHYSICAL PROPERTIES BECKMAN COULTER, INC. (US) 2024-02-29 WO claimed
US-20230399565-A1 POLYMER DYES AND USES THEREOF BECKMAN COULTER, INC. 2023-12-14 US claimed
US-20230371372-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-11-16 US claimed
US-6335418-B1 Functional polyamic acid microfine particles, functional polyimide microfine particles, and processes for their production OSAKA PREFECTURAL GOVERNMENT (JP) 2002-01-01 US claimed
US-6333392-B1 CONTROLLED PARTICLE SHAPE AND SIZE DISTRIBUTION, FROM A TETRACARBOXYLIC ANHYDRIDE AND A C=C BOND-CONTAINING ACID ANHYDRIDE WITH A SECOND SOLUTION CONTAINING A DIAMINE SUMITOMO BAKELITE AND CO. LTD. (JP) 2001-12-25 US claimed
EP-1152021-A1 Thermosetting polyamic acid microfine particles, thermosetting polyimide microfine particles, crosslinked polyimide microfine particles, and processes for their production OSAKA PREFECTURAL GOVERNMENT (JP) 2001-11-07 EP claimed
US-6187899-B1 PREPARING FIRST SOLUTION CONTAINING TETRACARBOXYLIC ANHYDRIDE AND SECOND SOLUTION CONTAINING DIAMINE, MIXING SOLUTIONS AND CAUSING POLYAMIC ACID TO PRECIPITATE UNDER ULTRASONIC AGITATION IN THE FORM OF MICROFINE PARTICLES OSAKA PREFECTURAL GOVERNMENT (JP) 2001-02-13 US claimed
EP-0982343-A2 Polyamic acid and polyimide microfine particles and processes for their production OSAKA PREFECTURAL GOVERNMENT (JP) 2000-03-01 EP claimed
WO-1996008352-A1 ELASTOMERIC ARTICLES ANSELL PERRY INC. (US) 1996-03-21 WO claimed
US-5470558-A Process for producing pitch-based carbon fibers superior in compression characteristics NIPPON OIL COMPANY, LIMITED (JP) 1995-11-28 US claimed
EP-0514190-B1 Process for producing pitch-based carbon fibers having superior compression characteristics NIPPON OIL CO LTD (JP) 1995-09-13 EP claimed
EP-0514190-A1 Process for producing pitch-based carbon fibers having superior compression characteristics NIPPON OIL COMPANY, LIMITED (JP) 1992-11-19 EP claimed
EP-0148678-A1 Method and catalyst for the treatment of heavy hydrogenated fractions produced by way of coal hydroliquefaction Etablissement public dit: CHARBONNAGES DE FRANCE (FR) 1985-07-17 EP claimed